Starting date and time: Tue Aug 13 02:13:09 CEST 2019 Calculation run on nodes/processors: *** SPO-DVR program version 5.16 (Compiled using IFORT for X86 on Jul 5 2019 at 10:16:08) run on 20190813 at 021309.460 *** * Using the new style input format... * OpenMP enabled ... * MPI disabled ... * NAG calls disabled ... * FFTW library will be used for FFTs ... * Estimate FFTW plans will be used for FFTs ... * Generic code will be used for diagonalizations ... * Extra check calls enabled ... * The internal timers of module Timers are not used ... * The FFT over R is performed using a single call ... * Full potential energy operation optimization has been enabled... * Potential energy multiplication optimization has been disabled... * Kinetic energy multiplication optimization has been disabled ... * Optimization of the kinetic energy operator routine in Z on the scattering grid has been disabled ... * Setting up global data... * Calculated machines precision: 0.55511151E-16 * Using a maximum number of 32 threads in this run. * Setting up global data... * Preparing module inputfields for reading the input file ... * Trying to read input file "DVR.inp" ... * Input file read OK ... *** THE INPUT PARAMETERS SETUP INTERNALLY BY THE PROGRAM *** * The surface lattice constant in X (bohr): 0.48638932E+01 * The surface lattice constant in Y (bohr): 0.48638932E+01 * The asymptotic value in Z (bohr): 0.15117808E+02 * The cutoff value in r (bohr): 0.10000000E+04 * The unit cell skewing angle (degrees): 0.60000000E+02 * The unit cell point group: C3v NOTE: If the potential switching option is used to switch the potential faster to the gas phase, the Z-value at which the potential first reaches the gas phase, is the new asymptotic Z-value. *** THE INPUT READ *** * Title: v0j8mj5-0.15eV-0.55eV * SystemID: CRPlibrary * NewCalc: T * Z degree of freedom: T * R degree of freedom: T * X degree of freedom: T * Y degree of freedom: T * Theta degree of freedom: T * Phi degree of freedom: T * Mass of atom 1 (amu): 0.10078000E+01 * Mass of atom 2 (amu): 0.10078000E+01 * Homo-nuclear molecule: T * Number of points on the scattering grid in Z: 198 * Step size of the scattering Z (bohr): 0.10000000E+00 * Starting point of the scattering in Z (bohr): -0.10000000E+01 * Number of points on the specular grid in Z: 252 * Number of points on the scattering grid in r: 56 * Step size of the scattering r (bohr): 0.15000000E+00 * Starting point of the scattering in r (bohr): 0.80000000E+00 * Specular grid in r is identical to the scattering grid in r. * Number of points on the scattering grid in X: 20 * Number of points on the scattering grid in Y: 20 * Maximum J value in grid representation.: 32 * Maximum Mj value in grid representation.: 32 * The projection operator scheme used: using two grids all the way * Propagation method used: Split operator * Calculation starts at (aut): 0.00000000E+00 * Calculation ends at (aut): 0.20000000E+05 * Time step used in the propagation (aut): 0.20000000E+01 * Number of time steps taken: 10000 * Only performing a fine analysis: F * Also performing a fine analysis: T * Wave function analysed every (aut): 0.50000000E+02 * Averages printed every (aut): 0.50000000E+02 * Initially using a dynamical specular analysis surface: T * Wave function analysed at (bohr): 0.15200000E+02 * Maximum J analysed: determined by the program (see info Analysis) * Maximum V analysed: determined by the program (see info Analysis) * Maximum diffraction order analysed: determined by the program (see info Analysis) * Number of energies that are on-the-fly analysed: 8 * Lowest energy of the initial wave packet: 0.15000000E+00 * Highest energy of the initial wave packet: 0.55000000E+00 * Average position of the initial wave packet: 0.17400000E+02 * Initial rotational quantum number J: 8 * Initial rotational quantum number Mj: 5 * Initial rotational quantum number V: 0 * Only computing the potential: F * Imposing a minimum value on the potential: F * Imposing a maximum value on the potential: T * Maximum value imposed on the potential: 0.10000000E+02 * Using symmetry in setting up the potential: F * Potential mixing alfa value: 0.00000000E+00 * Using a quadratic optical potential on the scattering grid in Z: * Optical potential in Z start at (bohr): 0.15200000E+02 * Optical potential in Z ends at (bohr): 0.18700000E+02 * Optical potential in Z absorbs optimally for (eV): 0.10000000E+00 * Using a quadratic optical potential on the scattering grid in r: * Optical potential in r start at (bohr): 0.45500000E+01 * Optical potential in r ends at (bohr): 0.90500000E+01 * Optical potential in r absorbs optimally for (eV): 0.10000000E+00 * Using a quadratic optical potential on the specular grid in Z: * Optical potential in Z start at (bohr): 0.19800000E+02 * Optical potential in Z ends at (bohr): 0.24100000E+02 * Optical potential in Z specular absorbs optimally for (eV 0.80000000E-01 * Initial energy parallel to the surface (eV): 0.00000000E+00 * Azimuthal angle of the incident molecule (degrees): 0.00000000E+00 * Using a switching function for the potential in Z: F * Switching function starts at (bohr): 0.65000000E+01 * Switching function ends at (bohr): 0.70000000E+01 * S-matrix elements written to file 3: T * Rot-vib-diff resolved probs written to file 25: T * Rot-diff resolved probs written to file 10: T * Dumping debug information to file: F * Dumping full S-matrix to file fil10: F * Tolerance for transferring the wavefunction (nproj = 2): 0.10000000E-08 * Validating the input... * Processing the input... *** THE INPUT FOR ROTATIONAL DEGREES OF FREEDOM *** * J in: 8 * Mj in: 5 * Maximum J value in grid rep.: 32 * HomeNuclear: T * A general MjIn independant grid will be used ... *** CONTINUING SETUP I *** * Setting up the FFT module ... * Setting up legendre module with JMax + 1 = 33 ... * Setting up the angular grid module with JMax = 32 ... * The nearest size allowed by FFT routines ( 66 ) for phi grid will be used ... * Setting up the angular grid and basis functions... *** THE GRID PARAMETERS *** * Number of phi's : 66 * Delta value in phi coordinate : 9.519977738150888E-002 * Number of theta's : 17 * JMax in basis set : 32 * JMin in basis set : 0 * Delta J in basis set : 2 * Grid has been set up for JIn = 8 , MjIn = 5 ... *** CONTINUING SETUP II *** * Setting up the angular DVR/FBR transform module and the transformation matric es ... *** SETUP DONE *** ******************************************************************************** INFO FROM MISCELLANEOUS SETUP ******************************************************************************** grid interval size in kz dir. (scat. grid) = 0.317333 grid interval size in kz dir. (spec. grid) = 0.249333 initial momentum in z direction = 9.275865 grid interval size in kr dir. = 0.747998 grid interval size in kx dir. = 1.491644 initial momentum in reciprocal x direction = 0.000000 grid interval size in ky dir. = 1.491644 initial momentum in reciprocal y direction = 0.000000 For backward compatibility: nmoder = 4 asymptotic analysis at z = 15.200000 No flux analysis performed. nzpot = 162 optical potential in z scat.grid: nzchsp = 163 z(nzchsp)= 15.200000 optical potential in z scat.grid: nzchmx = 198 z(nzchmx)= 18.700000 optical potential in z spec.grid: nschsp = 209 z(nschsp)= 19.800000 optical potential in z spec.grid: nschmx = 252 z(nschmx)= 24.100000 optical potential in r scat.grid: nrchsp = 26 r(nrchsp)= 4.550000 optical potential in r scat.grid: nrchmx = 56 r(nrchmx)= 9.050000 max kinetic energy in r (ev) = 6.497306 with current time interval in the analysis the max total energy for which results can be obtained (eV) = 1.709743 zero of etot is energy lowest h2 state the 95% confidence interval defined by alfwv and enrgy: ectmin (ev) = 0.150000 ectmax (ev) = 0.550000 Total time for potential initialisation = 0.35047531E-04 secs * Grids are setup! * 5-Mode arrays are allocated! * 4-Mode arrays are allocated! ******************************************************************************** INFO FROM SETTING UP THE INTERACTION POTENTIAL ******************************************************************************** * Setting up the Cu111_B86SRP68-DF2_Z8A_C3v PES... Number of points in Z for which the potential is calculated = 162 Number of points in r for which the potential is calculated = 56 Number of points in x for which the potential is calculated = 20 Number of points in y for which the potential is calculated = 20 Number of points in theta for which the potential is calculated = 17 Number of points in phi for which the potential is calculated = 66 iz = 1 iz = 2 iz = 3 iz = 4 iz = 5 iz = 6 iz = 7 iz = 8 iz = 9 iz = 10 iz = 11 iz = 12 iz = 13 iz = 14 iz = 15 iz = 16 iz = 17 iz = 18 iz = 19 iz = 20 iz = 21 iz = 22 iz = 23 iz = 24 iz = 25 iz = 26 iz = 27 iz = 28 iz = 29 iz = 30 iz = 31 iz = 32 iz = 33 iz = 34 iz = 35 iz = 36 iz = 37 iz = 38 iz = 39 iz = 40 iz = 41 iz = 42 iz = 43 iz = 44 iz = 45 iz = 46 iz = 47 iz = 48 iz = 49 iz = 50 iz = 51 iz = 52 iz = 53 iz = 54 iz = 55 iz = 56 iz = 57 iz = 58 iz = 59 iz = 60 iz = 61 iz = 62 iz = 63 iz = 64 iz = 65 iz = 66 iz = 67 iz = 68 iz = 69 iz = 70 iz = 71 iz = 72 iz = 73 iz = 74 iz = 75 iz = 76 iz = 77 iz = 78 iz = 79 iz = 80 iz = 81 iz = 82 iz = 83 iz = 84 iz = 85 iz = 86 iz = 87 iz = 88 iz = 89 iz = 90 iz = 91 iz = 92 iz = 93 iz = 94 iz = 95 iz = 96 iz = 97 iz = 98 iz = 99 iz = 100 iz = 101 iz = 102 iz = 103 iz = 104 iz = 105 iz = 106 iz = 107 iz = 108 iz = 109 iz = 110 iz = 111 iz = 112 iz = 113 iz = 114 iz = 115 iz = 116 iz = 117 iz = 118 iz = 119 iz = 120 iz = 121 iz = 122 iz = 123 iz = 124 iz = 125 iz = 126 iz = 127 iz = 128 iz = 129 iz = 130 iz = 131 iz = 132 iz = 133 iz = 134 iz = 135 iz = 136 iz = 137 iz = 138 iz = 139 iz = 140 iz = 141 iz = 142 iz = 144 iz = 148 iz = 152 iz = 156 iz = 160 iz = 145 iz = 149 iz = 153 iz = 157 iz = 143 iz = 161 iz = 146 iz = 150 iz = 154 iz = 158 iz = 162 iz = 147 iz = 151 iz = 155 iz = 159 Saving Cu111_B86SRP68-DF2_Z8A_C3v PES into file : ./Cu111_B86SRP68-DF2_Z8A_C3v_162_-1.000_0.100_56_0.800_0.150_20_20_4.864_32_32. pes WARNING in routine SetupThePES in module Potential: vdvr contains more indices than can be represented by a four byte integer. Therefore the result of the inquiry 'SIZE(vdvr)' will be wrong! Program continues with dirty trick fix. Beware! * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 Total time setting up the potential = 0.31705390E+04 secs ******************************************************************************** INFO FROM SETTING UP THE ROVIBARIONAL ASYMPTOTIC POTENTIAL ******************************************************************************** The gas phase vibrational potential for Z = 15.1178079086314 r(Bohr) V(eV) --------------------------------------------- 0.800000000000000 -0.614313158203822 0.950000000000000 -3.19102266083849 1.10000000000000 -4.45136825777271 1.25000000000000 -4.99984753548742 1.40000000000000 -5.15222895836725 1.55000000000000 -5.07205461356338 1.70000000000000 -4.85412985260776 1.85000000000000 -4.55365640658986 2.00000000000000 -4.20965954065202 2.15000000000000 -3.84476515750003 2.30000000000000 -3.47295832873381 2.45000000000000 -3.10772368458484 2.60000000000000 -2.75591917705669 2.75000000000000 -2.41910500293411 2.90000000000000 -2.09869395800417 3.05000000000000 -1.79612193194245 3.20000000000000 -1.51285210467923 3.35000000000000 -1.25033926714185 3.50000000000000 -1.00917613430596 3.65000000000000 -0.788439939242043 3.80000000000000 -0.587054085255137 3.95000000000000 -0.403941975650272 4.10000000000000 -0.238027013732485 4.25000000000000 -8.823260280680591E-002 4.40000000000000 -8.846257060213248E-013 4.55000000000000 -8.846257060213248E-013 4.70000000000000 -8.846257060213248E-013 4.85000000000000 -8.846257060213248E-013 5.00000000000000 -8.846257060213248E-013 5.15000000000000 -8.846257060213248E-013 5.30000000000000 -8.846257060213248E-013 5.45000000000000 -8.846257060213248E-013 5.60000000000000 -8.846257060213248E-013 5.75000000000000 -8.846257060213248E-013 5.90000000000000 -8.846257060213248E-013 6.05000000000000 -8.846257060213248E-013 6.20000000000000 -8.846257060213248E-013 6.35000000000000 -8.846257060213248E-013 6.50000000000000 -8.846257060213248E-013 6.65000000000000 -8.846257060213248E-013 6.80000000000000 -8.846257060213248E-013 6.95000000000000 -8.846257060213248E-013 7.10000000000000 -8.846257060213248E-013 7.25000000000000 -8.846257060213248E-013 7.40000000000000 -8.846257060213248E-013 7.55000000000000 -8.846257060213248E-013 7.70000000000000 -8.846257060213248E-013 7.85000000000000 -8.846257060213248E-013 8.00000000000000 -8.846257060213248E-013 8.15000000000000 -8.846257060213248E-013 8.30000000000000 -8.846257060213248E-013 8.45000000000000 -8.846257060213248E-013 8.60000000000000 -8.846257060213248E-013 8.75000000000000 -8.846257060213248E-013 8.90000000000000 -8.846257060213248E-013 9.05000000000000 -8.846257060213248E-013 * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 ******************************************************************************** INFO FROM SETTING UP THE ASYMPTOTIC ROVIBRATIONAL STATES ******************************************************************************** asymptotic molecular vibrational wave functions v j e(ev) erel(ev) psi(1) psi(nr) norm 0 0 -4.886560 -0.495022 0.1108407D-01 0.6766701D-03 1.0000000 1.4592222 0 1 -4.872088 -0.480550 0.1074900D-01 0.6544072D-03 1.0000000 1.4614064 0 2 -4.843277 -0.451739 0.1010829D-01 0.6120063D-03 1.0000000 1.4657641 0 3 -4.800385 -0.408847 0.9216637D-02 0.5533927D-03 1.0000000 1.4722741 0 4 -4.743793 -0.352255 0.8146544D-02 0.4837088D-03 1.0000000 1.4809057 0 5 -4.673990 -0.282452 0.6978806D-02 0.4085885D-03 1.0000000 1.4916191 0 6 -4.591560 -0.200022 0.5792699D-02 0.3334277D-03 1.0000000 1.5043673 0 7 -4.497167 -0.105629 0.4657444D-02 0.2627771D-03 1.0000000 1.5190968 0 8 -4.391538 0.000000 0.3626184D-02 0.1999469D-03 1.0000000 1.5357497 0 9 -4.275447 0.116091 0.2733089D-02 0.1468600D-03 1.0000000 1.5542650 0 10 -4.149699 0.241839 0.1993548D-02 0.1041307D-03 1.0000000 1.5745804 0 11 -4.015115 0.376423 0.1406814D-02 0.7131162D-04 1.0000000 1.5966338 0 12 -3.872520 0.519018 0.9601839D-03 0.4722808D-04 1.0000000 1.6203649 0 13 -3.722731 0.668807 0.6336524D-03 0.3032238D-04 1.0000000 1.6457168 0 14 -3.566546 0.824993 0.4042006D-03 0.1895074D-04 1.0000000 1.6726370 0 15 -3.404739 0.986799 0.2491495D-03 0.1159880D-04 1.0000000 1.7010784 0 16 -3.238056 1.153482 0.1483557D-03 0.7007247D-05 1.0000000 1.7310003 0 17 -3.067207 1.324331 0.8530722D-04 0.4216678D-05 1.0000000 1.7623681 0 18 -2.892866 1.498672 0.4735220D-04 0.2552000D-05 1.0000000 1.7951540 0 19 -2.715668 1.675870 0.2535977D-04 0.1570764D-05 1.0000000 1.8293366 0 20 -2.536212 1.855326 0.1309290D-04 0.9984743D-06 1.0000000 1.8649010 0 21 -2.355055 2.036483 0.6506324D-05 0.6687072D-06 1.0000000 1.9018391 0 22 -2.172720 2.218818 0.3103067D-05 0.4784094D-06 1.0000000 1.9401511 0 23 -1.989692 2.401846 0.1413474D-05 0.3609022D-06 1.0000000 1.9798469 0 24 -1.806422 2.585116 0.6108915D-06 0.2730916D-06 1.0000000 2.0209484 0 25 -1.623330 2.768208 0.2496658D-06 0.1905184D-06 1.0000000 2.0634922 0 26 -1.440808 2.950730 0.9869287D-07 0.1043847D-06 1.0000000 2.1075305 0 27 -1.259222 3.132316 0.4237105D-07 0.1735779D-07 1.0000000 2.1531306 0 28 -1.078916 3.312622 -0.2502810D-07 0.6205393D-07 1.0000000 2.2003723 0 29 -0.900213 3.491325 -0.2121238D-07 0.1249720D-06 1.0000000 2.2493422 0 30 -0.723415 3.668123 -0.2031340D-07 0.1657846D-06 1.0000000 2.3001271 0 31 -0.548804 3.842735 -0.1871562D-07 0.1833134D-06 1.0000000 2.3528071 0 32 -0.376639 4.014900 -0.1582985D-07 0.1800695D-06 1.0000000 2.4074525 1 0 -4.377131 0.014408 0.2956956D-01 0.2094185D-02 1.0000000 1.5567653 1 1 -4.363394 0.028144 0.2872491D-01 0.2028557D-02 1.0000000 1.5589873 1 2 -4.336044 0.055494 0.2710458D-01 0.1903183D-02 1.0000000 1.5634221 1 3 -4.295327 0.096212 0.2483768D-01 0.1728998D-02 1.0000000 1.5700508 1 4 -4.241599 0.149939 0.2209741D-01 0.1520482D-02 1.0000000 1.5788466 1 5 -4.175323 0.216215 0.1908004D-01 0.1293749D-02 1.0000000 1.5897747 1 6 -4.097050 0.294488 0.1598258D-01 0.1064561D-02 1.0000000 1.6027943 1 7 -4.007410 0.384128 0.1298220D-01 0.8466080D-03 1.0000000 1.6178591 1 8 -3.907091 0.484448 0.1022065D-01 0.6502907D-03 1.0000000 1.6349192 1 9 -3.796830 0.594709 0.7795213D-02 0.4821432D-03 1.0000000 1.6539220 1 10 -3.677394 0.714144 0.5756893D-02 0.3448852D-03 1.0000000 1.6748131 1 11 -3.549570 0.841968 0.4114855D-02 0.2379758D-03 1.0000000 1.6975372 1 12 -3.414146 0.977392 0.2845305D-02 0.1584757D-03 1.0000000 1.7220385 1 13 -3.271907 1.119631 0.1902477D-02 0.1020129D-03 1.0000000 1.7482614 1 14 -3.123619 1.267919 0.1229541D-02 0.6367986D-04 1.0000000 1.7761507 1 15 -2.970025 1.421513 0.7677620D-03 0.3874540D-04 1.0000000 1.8056544 1 16 -2.811840 1.579698 0.4630331D-03 0.2312868D-04 1.0000000 1.8367256 1 17 -2.649741 1.741797 0.2696261D-03 0.1363161D-04 1.0000000 1.8693275 1 18 -2.484372 1.907166 0.1515515D-03 0.7964809D-05 1.0000000 1.9034382 1 19 -2.316341 2.075197 0.8220347D-04 0.4625799D-05 1.0000000 1.9390543 1 20 -2.146220 2.245318 0.4300803D-04 0.2699686D-05 1.0000000 1.9761940 1 21 -1.974553 2.416985 0.2167862D-04 0.1649070D-05 1.0000000 2.0148935 1 22 -1.801852 2.589686 0.1049672D-04 0.1143608D-05 1.0000000 2.0552011 1 23 -1.628604 2.762934 0.4849161D-05 0.9535120D-06 1.0000000 2.0971646 1 24 -1.455263 2.936275 0.2106913D-05 0.9041519D-06 1.0000000 2.1408178 1 25 -1.282253 3.109285 0.8363547D-06 0.8699011D-06 1.0000000 2.1861690 1 26 -1.109959 3.281579 0.2853172D-06 0.7800547D-06 1.0000000 2.2331972 1 27 -0.938728 3.452810 0.7152578D-07 0.6172292D-06 1.0000000 2.2818597 1 28 -0.768863 3.622676 0.5955816D-08 0.4025537D-06 1.0000000 2.3321141 1 29 -0.600629 3.790909 -0.1855380D-08 0.1736366D-06 1.0000000 2.3839503 1 30 -0.434265 3.957273 -0.7203174D-08 0.3474696D-07 1.0000000 2.4374261 1 31 -0.269989 4.121549 -0.1667264D-07 0.2008302D-06 1.0000000 2.4926969 1 32 -0.108020 4.283518 -0.2151494D-07 0.3169960D-06 1.0000000 2.5500321 2 0 -3.893806 0.497732 0.5771819D-01 0.4751239D-02 1.0000000 1.6575165 2 1 -3.880782 0.510756 0.5615908D-01 0.4609568D-02 1.0000000 1.6597984 2 2 -3.854850 0.536688 0.5315887D-01 0.4338129D-02 1.0000000 1.6643531 2 3 -3.816243 0.575296 0.4894017D-01 0.3959188D-02 1.0000000 1.6711626 2 4 -3.765299 0.626239 0.4380517D-01 0.3502542D-02 1.0000000 1.6802002 2 5 -3.702455 0.689083 0.3810226D-01 0.3001846D-02 1.0000000 1.6914311 2 6 -3.628235 0.763304 0.3218887D-01 0.2490697D-02 1.0000000 1.7048133 2 7 -3.543232 0.848306 0.2639577D-01 0.1999073D-02 1.0000000 1.7202983 2 8 -3.448099 0.943439 0.2099758D-01 0.1550658D-02 1.0000000 1.7378329 2 9 -3.343534 1.048005 0.1619351D-01 0.1161345D-02 1.0000000 1.7573614 2 10 -3.230260 1.161278 0.1209991D-01 0.8389907D-03 1.0000000 1.7788292 2 11 -3.109020 1.282518 0.8754491D-02 0.5842474D-03 1.0000000 1.8021864 2 12 -2.980561 1.410977 0.6129547D-02 0.3921294D-03 1.0000000 1.8273924 2 13 -2.845627 1.545911 0.4150647D-02 0.2539269D-03 1.0000000 1.8544197 2 14 -2.704953 1.686585 0.2716632D-02 0.1591155D-03 1.0000000 1.8832547 2 15 -2.559257 1.832281 0.1717553D-02 0.9700017D-04 1.0000000 1.9138957 2 16 -2.409239 1.982299 0.1048338D-02 0.5794320D-04 1.0000000 1.9463452 2 17 -2.255573 2.135965 0.6174369D-03 0.3411118D-04 1.0000000 1.9806003 2 18 -2.098905 2.292633 0.3507947D-03 0.1975138D-04 1.0000000 2.0166416 2 19 -1.939841 2.451697 0.1922546D-03 0.1106586D-04 1.0000000 2.0544251 2 20 -1.778945 2.612593 0.1016680D-03 0.5806463D-05 1.0000000 2.0938824 2 21 -1.616734 2.774804 0.5189138D-04 0.2750023D-05 1.0000000 2.1349296 2 22 -1.453671 2.937867 0.2554657D-04 0.1212388D-05 1.0000000 2.1774871 2 23 -1.290177 3.101362 0.1208783D-04 0.7130541D-06 1.0000000 2.2215056 2 24 -1.126630 3.264908 0.5441000D-05 0.8240646D-06 1.0000000 2.2669927 2 25 -0.963384 3.428154 0.2274031D-05 0.1161683D-05 1.0000000 2.3140301 2 26 -0.800777 3.590761 0.8340432D-06 0.1439803D-05 1.0000000 2.3627752 2 27 -0.639142 3.752396 0.2271824D-06 0.1510905D-05 1.0000000 2.4134430 2 28 -0.478807 3.912731 0.6553576D-08 0.1358787D-05 1.0000000 2.4662759 2 29 -0.320101 4.071437 -0.4767921D-07 0.1049775D-05 1.0000000 2.5215137 2 30 -0.163340 4.228198 -0.4035016D-07 0.6729239D-06 1.0000000 2.5793812 2 31 -0.008828 4.382710 -0.1809269D-07 0.2977293D-06 1.0000000 2.6401056 2 32 0.143150 4.534689 -0.8700250D-09 0.4330716D-07 1.0000000 2.7039613 energy initial v,j state = -4.391538 potential energy = -4.987158 rotational energy = 0.470085 vibrational energy = 0.125535 rovibrational energy = 0.595619 expectation value r = 1.535750 ******************************************************************************** INFO FROM SETTING UP THE DIFFRACTION BASIS ******************************************************************************** WARNING: Diffractional basis too small to describe all open channels! 400 diffraction channels in basis (ndftow) * Number of diffraction states analysed, ndifa = 271 * Highest diffraction order, maxord = 19 * Largest number of diffraction states that belong to the same diffraction order, maxnum = 54 ******************************************************************************** INFO FROM SETTING UP THE ROTATION BASIS ******************************************************************************** 561 rotation channels in basis (nrotw) * number of rotational states analysed, nana = 91 * initial rotational state in basis, ichn = 353 ******************************************************************************** INFO FROM SETTING UP THE ROTATION-DIFFRACTION BASIS ******************************************************************************** ***** rotation-diffraction channels in basis (nstatw) * Number of rotation-diffraction analysed, nstata = 24661 * Index of initial rot-dif channel in basis, inchna = 19513 ******************************************************************************** INFO FROM SETTING UP THE OPTICAL POTENTIALS ******************************************************************************** * Optical potential in Z absorbs with coefficient: 0.83111374E-02 * Optical potential in r absorbs with coefficient: 0.93569763E-02 * Optical potential in Z specular absorbs with coefficient: 0.64071284E-02 ******************************************************************************** INFO FROM SETTING UP THE GRID ENERGIES ******************************************************************************** * Maximum diffraction order included on the momentum grid = 0 * Number of diffraction channels included = 0 * Number of diffraction channels excluded = 0 * initial parallel energy (eV) = 0.00000000E+00 ******************************************************************************** INFO FROM SETTING UP THE KINETIC ENERGY OPERATORS ******************************************************************************** ******************************************************************************** INFO FROM SETTING UP THE WAVE FUNCTION ******************************************************************************** * Norm initial wave packet (Z,r) = 0.10000000E+01 * Absolute value of the wave function in momentum space: - at k = 0 0.20426229E-04 - at the end/beginning of the grid 0.20158188E-14 - maximum value = 0.52335254E+00 * Grid point boundaries between which initial wave packet must be located: - Low boundary (asymptotic value of Z), iLow = 163 - High boundary (start of opt. pot on spec. grid), iHigh = 208 * Norm of the initial wave packet between iLow and iHigh = 0.10000000E+01 ******************************************************************************** INFO FROM SETTING UP THE ANALYSIS ******************************************************************************** * Tolerance for fixing the dynamical analysis surface on the specular grid = 0.10000000E-08 * Maximum j in analysis: jana = 12 * Maximum v in analysis: nviba = 3 * Maximum diffraction order in analysis: mdifa = 9 ******************************************************************************** INFO FROM SETTING UP THE SPLIT OPERATOR PROPAGATOR ******************************************************************************** ----- Split operator propagator set up ----- ******************************************************************************** INFO ON PROPAGATING THE WAVE PACKET ******************************************************************************** time norm z r rest norm 0.00000000E+00 1.00000000 17.40000000 1.53574968 0.10000000E+01 0.50000000E+02 0.99999999 17.27377086 1.53575595 0.99999999E+00 0.10000000E+03 0.99999998 17.14754172 1.53576245 0.99999997E+00 0.15000000E+03 0.99999998 17.02131258 1.53576358 0.99999980E+00 0.20000000E+03 0.99999997 16.89508344 1.53576327 0.99999855E+00 0.25000000E+03 0.99999996 16.76885430 1.53576208 0.99998985E+00 0.30000000E+03 0.99999995 16.64262516 1.53575699 0.99993931E+00 0.35000000E+03 0.99999994 16.51639602 1.53575039 0.99969724E+00 0.40000000E+03 0.99999993 16.39016687 1.53575402 0.99874791E+00 0.45000000E+03 0.99999993 16.26393773 1.53576283 0.99569675E+00 0.50000000E+03 0.99999992 16.13770858 1.53576403 0.98760724E+00 0.55000000E+03 0.99999991 16.01147941 1.53576306 0.96972261E+00 0.60000000E+03 0.99999990 15.88525016 1.53576173 0.93629620E+00 0.65000000E+03 0.99999989 15.75902072 1.53575759 0.88265997E+00 0.70000000E+03 0.99999989 15.63279086 1.53575147 0.80756273E+00 0.75000000E+03 0.99999988 15.50656013 1.53575255 0.71431863E+00 0.80000000E+03 0.99999987 15.38032789 1.53576231 0.61003008E+00 0.85000000E+03 0.99999986 15.25409318 1.53576495 0.50340989E+00 0.90000000E+03 0.99999985 15.12785481 1.53576291 0.40241938E+00 0.95000000E+03 0.99999984 15.00161134 1.53576136 0.31270931E+00 0.10000000E+04 0.99999984 14.87536121 1.53575794 0.23716178E+00 0.10500000E+04 0.99999983 14.74910281 1.53575248 0.17627134E+00 0.11000000E+04 0.99999982 14.62283452 1.53575195 0.12891004E+00 0.11500000E+04 0.99999981 14.49655480 1.53576079 0.93104775E-01 0.12000000E+04 0.99999980 14.37026218 1.53576638 0.66633383E-01 0.12500000E+04 0.99999979 14.24395525 1.53576299 0.47394719E-01 0.13000000E+04 0.99999979 14.11763261 1.53576159 0.33589151E-01 0.13500000E+04 0.99999978 13.99129288 1.53575904 0.23771132E-01 0.14000000E+04 0.99999977 13.86493455 1.53575533 0.16830009E-01 0.14500000E+04 0.99999976 13.73855600 1.53575548 0.11939073E-01 0.15000000E+04 0.99999975 13.61215540 1.53576527 0.84968641E-02 0.15500000E+04 0.99999975 13.48573067 1.53577665 0.60728911E-02 0.16000000E+04 0.99999974 13.35927939 1.53577906 0.43625372E-02 0.16500000E+04 0.99999973 13.23279881 1.53578266 0.31518931E-02 0.17000000E+04 0.99999972 13.10628577 1.53579034 0.22914455E-02 0.17500000E+04 0.99999971 12.97973674 1.53579791 0.16769331E-02 0.18000000E+04 0.99999970 12.85314776 1.53581099 0.12356814E-02 0.18500000E+04 0.99999970 12.72651450 1.53583463 0.91698057E-03 0.19000000E+04 0.99999969 12.59983228 1.53586421 0.68536712E-03 0.19500000E+04 0.99999968 12.47309611 1.53588769 0.51596036E-03 0.20000000E+04 0.99999967 12.34630073 1.53590957 0.39123504E-03 0.20500000E+04 0.99999966 12.21944066 1.53593932 0.29879176E-03 0.21000000E+04 0.99999965 12.09251027 1.53596985 0.22981310E-03 0.21500000E+04 0.99999965 11.96550378 1.53600500 0.17799624E-03 0.22000000E+04 0.99999964 11.83841530 1.53604941 0.13881063E-03 0.22500000E+04 0.99999963 11.71123885 1.53610084 0.10898069E-03 0.23000000E+04 0.99999962 11.58396839 1.53614719 0.86124845E-04 0.23500000E+04 0.99999961 11.45659781 1.53618786 0.68500086E-04 0.24000000E+04 0.99999961 11.32912097 1.53623478 0.54823593E-04 0.24500000E+04 0.99999960 11.20153164 1.53628467 0.44145388E-04 0.25000000E+04 0.99999959 11.07382358 1.53633488 0.35757770E-04 0.25500000E+04 0.99999958 10.94599054 1.53639371 0.29130426E-04 0.26000000E+04 0.99999957 10.81802628 1.53645812 0.23863685E-04 0.26500000E+04 0.99999956 10.68992461 1.53651967 0.19654383E-04 0.27000000E+04 0.99999956 10.56167947 1.53657288 0.16272192E-04 0.27500000E+04 0.99999955 10.43328501 1.53662945 0.13539961E-04 0.28000000E+04 0.99999954 10.30473568 1.53669262 0.11321431E-04 0.28500000E+04 0.99999953 10.17602633 1.53675494 0.95110664E-05 0.29000000E+04 0.99999952 10.04715242 1.53682431 0.80266835E-05 0.29500000E+04 0.99999952 9.91811015 1.53690146 0.68037268E-05 0.30000000E+04 0.99999951 9.78889667 1.53697791 0.57920202E-05 0.30500000E+04 0.99999950 9.65951036 1.53704807 0.49512701E-05 0.31000000E+04 0.99999949 9.52995102 1.53712035 0.42496106E-05 0.31500000E+04 0.99999948 9.40022027 1.53720398 0.36615847E-05 0.32000000E+04 0.99999947 9.27032182 1.53729284 0.31667890E-05 0.32500000E+04 0.99999947 9.14026183 1.53738961 0.27488146E-05 0.33000000E+04 0.99999946 9.01004937 1.53750252 0.23944007E-05 0.33500000E+04 0.99999945 8.87969680 1.53762360 0.20927702E-05 0.34000000E+04 0.99999944 8.74922024 1.53774984 0.18351271E-05 0.34500000E+04 0.99999943 8.61864005 1.53788762 0.16142835E-05 0.35000000E+04 0.99999942 8.48798135 1.53805248 0.14243626E-05 0.35500000E+04 0.99999942 8.35727451 1.53824453 0.12603034E-05 0.36000000E+04 0.99999941 8.22655570 1.53846485 0.11185791E-05 0.36500000E+04 0.99999940 8.09586736 1.53872724 0.99557152E-06 0.37000000E+04 0.99999939 7.96525880 1.53903321 0.88844447E-06 0.37500000E+04 0.99999938 7.83478663 1.53938124 0.79483353E-06 0.38000000E+04 0.99999937 7.70451525 1.53978350 0.71279117E-06 0.38500000E+04 0.99999936 7.57451733 1.54025898 0.64071323E-06 0.39000000E+04 0.99999934 7.44487414 1.54082122 0.57725795E-06 0.39500000E+04 0.99999932 7.31567594 1.54147278 0.52107745E-06 0.40000000E+04 0.99999928 7.18702216 1.54223063 0.47160722E-06 0.40500000E+04 0.99999922 7.05902162 1.54310813 0.42778471E-06 0.41000000E+04 0.99999913 6.93179263 1.54410552 0.38886678E-06 0.41500000E+04 0.99999898 6.80546290 1.54523531 0.35419775E-06 0.42000000E+04 0.99999873 6.68016943 1.54651603 0.32321220E-06 0.42500000E+04 0.99999834 6.55605825 1.54796217 0.29545117E-06 0.43000000E+04 0.99999773 6.43328403 1.54957430 0.27056190E-06 0.43500000E+04 0.99999679 6.31200954 1.55135476 0.24806735E-06 0.44000000E+04 0.99999539 6.19240501 1.55331008 0.22810142E-06 0.44500000E+04 0.99999333 6.07464740 1.55543013 0.21017557E-06 0.45000000E+04 0.99999036 5.95891954 1.55770374 0.19400188E-06 0.45500000E+04 0.99998617 5.84540909 1.56012938 0.17932619E-06 0.46000000E+04 0.99998038 5.73430755 1.56269842 0.16595561E-06 0.46500000E+04 0.99997251 5.62580904 1.56539217 0.15375442E-06 0.47000000E+04 0.99996200 5.52010902 1.56818456 0.14262019E-06 0.47500000E+04 0.99994821 5.41740299 1.57105629 0.13246372E-06 0.48000000E+04 0.99993042 5.31788510 1.57398005 0.12320513E-06 0.48500000E+04 0.99990782 5.22174677 1.57692133 0.11477687E-06 0.49000000E+04 0.99987956 5.12917529 1.57985409 0.10711815E-06 0.49500000E+04 0.99984474 5.04035248 1.58275251 0.99955660E-07 0.50000000E+04 0.99980246 4.95545345 1.58558145 0.93621729E-07 0.50500000E+04 0.99975182 4.87464546 1.58829981 0.87813684E-07 0.51000000E+04 0.99969201 4.79808688 1.59086767 0.82440395E-07 0.51500000E+04 0.99962228 4.72592639 1.59324723 0.77433678E-07 0.52000000E+04 0.99954203 4.65830222 1.59539590 0.72756391E-07 0.52500000E+04 0.99945082 4.59534157 1.59728105 0.68395112E-07 0.53000000E+04 0.99934841 4.53716000 1.59888380 0.64346605E-07 0.53500000E+04 0.99923477 4.48386087 1.60019121 0.60606959E-07 0.54000000E+04 0.99911009 4.43553472 1.60119665 0.57165237E-07 0.54500000E+04 0.99897484 4.39225874 1.60190140 0.54004297E-07 0.55000000E+04 0.99882967 4.35409621 1.60231389 0.51094939E-07 0.55500000E+04 0.99867549 4.32109625 1.60244093 0.48219128E-07 0.56000000E+04 0.99851339 4.29329374 1.60228760 0.45721974E-07 0.56500000E+04 0.99834463 4.27070950 1.60186245 0.43370828E-07 0.57000000E+04 0.99817062 4.25335076 1.60117243 0.41159606E-07 0.57500000E+04 0.99799287 4.24121180 1.60022314 0.39071346E-07 0.58000000E+04 0.99781294 4.23427463 1.59902580 0.37091800E-07 0.58500000E+04 0.99763243 4.23250974 1.59760197 0.35267172E-07 0.59000000E+04 0.99745291 4.23587660 1.59598372 0.33591280E-07 0.59500000E+04 0.99727589 4.24432411 1.59420911 0.32027160E-07 0.60000000E+04 0.99710283 4.25779088 1.59232079 0.30615742E-07 0.60500000E+04 0.99693506 4.27620552 1.59035722 0.29254800E-07 0.61000000E+04 0.99677380 4.29948710 1.58834262 0.27863141E-07 0.61500000E+04 0.99662012 4.32754572 1.58628560 0.26691733E-07 0.62000000E+04 0.99647494 4.36028343 1.58418389 0.25605802E-07 0.62500000E+04 0.99633902 4.39759518 1.58203338 0.24046965E-07 0.63000000E+04 0.99621293 4.43936976 1.57983896 0.22921592E-07 0.63500000E+04 0.99609704 4.48549060 1.57762390 0.22244268E-07 0.64000000E+04 0.99599155 4.53583619 1.57543028 0.20962330E-07 0.64500000E+04 0.99589644 4.59028045 1.57330511 0.19692919E-07 0.65000000E+04 0.99581153 4.64869314 1.57128304 0.19852651E-07 0.65500000E+04 0.99573647 4.71094042 1.56937273 0.19547935E-07 0.66000000E+04 0.99567078 4.77688590 1.56755361 0.17603422E-07 0.66500000E+04 0.99561383 4.84639184 1.56578787 0.17754558E-07 0.67000000E+04 0.99556492 4.91932032 1.56404361 0.20432442E-07 0.67500000E+04 0.99552326 4.99553418 1.56231725 0.20133718E-07 0.68000000E+04 0.99548803 5.07489733 1.56063908 0.18390830E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16800000E+02 0.68500000E+04 0.99545839 5.15727471 1.55905787 0.23674239E-07 0.69000000E+04 0.99543354 5.24253197 1.55761335 0.32651857E-07 0.69500000E+04 0.99541269 5.33053536 1.55631119 0.35371205E-07 0.70000000E+04 0.99539517 5.42115181 1.55511698 0.39727257E-07 0.70500000E+04 0.99538036 5.51424947 1.55397423 0.60893277E-07 0.71000000E+04 0.99536773 5.60969834 1.55283692 0.91023290E-07 0.71500000E+04 0.99535684 5.70737073 1.55169666 0.11528841E-06 0.72000000E+04 0.99534732 5.80714162 1.55058639 0.15054368E-06 0.72500000E+04 0.99533880 5.90888863 1.54955822 0.22661493E-06 0.73000000E+04 0.99533097 6.01249200 1.54864865 0.33820323E-06 0.73500000E+04 0.99532349 6.11783459 1.54785395 0.46525421E-06 0.74000000E+04 0.99531598 6.22480204 1.54713208 0.63784836E-06 0.74500000E+04 0.99530802 6.33328311 1.54642988 0.92585662E-06 0.75000000E+04 0.99529912 6.44316993 1.54571732 0.13600863E-05 0.75500000E+04 0.99528871 6.55435815 1.54500585 0.19280727E-05 0.76000000E+04 0.99527610 6.66674684 1.54433801 0.26756837E-05 0.76500000E+04 0.99526046 6.78023822 1.54375574 0.37561721E-05 0.77000000E+04 0.99524083 6.89473738 1.54326943 0.53335230E-05 0.77500000E+04 0.99521608 7.01015200 1.54284926 0.74838572E-05 0.78000000E+04 0.99518488 7.12639221 1.54244445 0.10270199E-04 0.78500000E+04 0.99514568 7.24337060 1.54201706 0.13910015E-04 0.79000000E+04 0.99509674 7.36100219 1.54156685 0.18790727E-04 0.79500000E+04 0.99503605 7.47920439 1.54112940 0.25283634E-04 0.80000000E+04 0.99496138 7.59789693 1.54074878 0.33601536E-04 0.80500000E+04 0.99487023 7.71700178 1.54044516 0.43918729E-04 0.81000000E+04 0.99475986 7.83644303 1.54020050 0.56620170E-04 0.81500000E+04 0.99462727 7.95614685 1.53997166 0.72351326E-04 0.82000000E+04 0.99446921 8.07604152 1.53972098 0.91777846E-04 0.82500000E+04 0.99428217 8.19605749 1.53944263 0.11533420E-03 0.83000000E+04 0.99406241 8.31612740 1.53916550 0.14328007E-03 0.83500000E+04 0.99380596 8.43618614 1.53893023 0.17601615E-03 0.84000000E+04 0.99350861 8.55617082 1.53875792 0.21430678E-03 0.84500000E+04 0.99316592 8.67602080 1.53863409 0.25916714E-03 0.85000000E+04 0.99277324 8.79567755 1.53851871 0.31156829E-03 0.85500000E+04 0.99232569 8.91508460 1.53837455 0.37232531E-03 0.86000000E+04 0.99181812 9.03418735 1.53819378 0.44233505E-03 0.86500000E+04 0.99124512 9.15293292 1.53800337 0.52297580E-03 0.87000000E+04 0.99060099 9.27126982 1.53784445 0.61632686E-03 0.87500000E+04 0.98987967 9.38914770 1.53774128 0.72506916E-03 0.88000000E+04 0.98907473 9.50651705 1.53768338 0.85222217E-03 0.88500000E+04 0.98817935 9.62332896 1.53763363 0.10010101E-02 0.89000000E+04 0.98718629 9.73953503 1.53755523 0.11750126E-02 0.89500000E+04 0.98608794 9.85508735 1.53743835 0.13784930E-02 0.90000000E+04 0.98487631 9.96993872 1.53730711 0.16166359E-02 0.90500000E+04 0.98354311 10.08404292 1.53720117 0.18954624E-02 0.91000000E+04 0.98207979 10.19735509 1.53714525 0.22213932E-02 0.91500000E+04 0.98047764 10.30983214 1.53713035 0.26006610E-02 0.92000000E+04 0.97872787 10.42143319 1.53712038 0.30388407E-02 0.92500000E+04 0.97682167 10.53211993 1.53707835 0.35406358E-02 0.93000000E+04 0.97475036 10.64185711 1.53699320 0.41098584E-02 0.93500000E+04 0.97250542 10.75061282 1.53688831 0.47493884E-02 0.94000000E+04 0.97007863 10.85835887 1.53680455 0.54609009E-02 0.94500000E+04 0.96746212 10.96507104 1.53676976 0.62443297E-02 0.95000000E+04 0.96464850 11.07072925 1.53677795 0.70972402E-02 0.95500000E+04 0.96163083 11.17531764 1.53679401 0.80143579E-02 0.96000000E+04 0.95840271 11.27882439 1.53677935 0.89874906E-02 0.96500000E+04 0.95495820 11.38124150 1.53671968 0.10005875E-01 0.97000000E+04 0.95129181 11.48256420 1.53663545 0.11056773E-01 0.97500000E+04 0.94739832 11.58279025 1.53656693 0.12126127E-01 0.98000000E+04 0.94327265 11.68191898 1.53654409 0.13199142E-01 0.98500000E+04 0.93890969 11.77995030 1.53656398 0.14260790E-01 0.99000000E+04 0.93430408 11.87688352 1.53659310 0.15296351E-01 0.99500000E+04 0.92945001 11.97271630 1.53659224 0.16292017E-01 0.10000000E+05 0.92434104 12.06744377 1.53654476 0.17235507E-01 0.10050000E+05 0.91897001 12.16105779 1.53646891 0.18116687E-01 0.10100000E+05 0.91332898 12.25354662 1.53640490 0.18928110E-01 0.10150000E+05 0.90740924 12.34489482 1.53638514 0.19665297E-01 0.10200000E+05 0.90120143 12.43508352 1.53641001 0.20326718E-01 0.10250000E+05 0.89469570 12.52409091 1.53644781 0.20913383E-01 0.10300000E+05 0.88788197 12.61189295 1.53645867 0.21428148E-01 0.10350000E+05 0.88075008 12.69846412 1.53642366 0.21874896E-01 0.10400000E+05 0.87329015 12.78377819 1.53635836 0.22257761E-01 0.10450000E+05 0.86549282 12.86780896 1.53630152 0.22580568E-01 0.10500000E+05 0.85734954 12.95053094 1.53628587 0.22846654E-01 0.10550000E+05 0.84885285 13.03191994 1.53631300 0.23058989E-01 0.10600000E+05 0.83999672 13.11195369 1.53635192 0.23220457E-01 0.10650000E+05 0.83077678 13.19061234 1.53636297 0.23334075E-01 0.10700000E+05 0.82119066 13.26787895 1.53632786 0.23402997E-01 0.10750000E+05 0.81123819 13.34373986 1.53626381 0.23430341E-01 0.10800000E+05 0.80092162 13.41818507 1.53621170 0.23419013E-01 0.10850000E+05 0.79024577 13.49120838 1.53620559 0.23371595E-01 0.10900000E+05 0.77921810 13.56280750 1.53624559 0.23290402E-01 0.10950000E+05 0.76784877 13.63298402 1.53629615 0.23177643E-01 0.11000000E+05 0.75615056 13.70174325 1.53631214 0.23035570E-01 0.11050000E+05 0.74413883 13.76909407 1.53627317 0.22866522E-01 0.11100000E+05 0.73183128 13.83504867 1.53619995 0.22672901E-01 0.11150000E+05 0.71924776 13.89962226 1.53614113 0.22457125E-01 0.11200000E+05 0.70640990 13.96283268 1.53613839 0.22221598E-01 0.11250000E+05 0.69334079 14.02470006 1.53619396 0.21968648E-01 0.11300000E+05 0.68006447 14.08524620 1.53626605 0.21700431E-01 0.11350000E+05 0.66660552 14.14449408 1.53629779 0.21418791E-01 0.11400000E+05 0.65298858 14.20246718 1.53625894 0.21125066E-01 0.11450000E+05 0.63923795 14.25918898 1.53616937 0.20819976E-01 0.11500000E+05 0.62537730 14.31468246 1.53608750 0.20503742E-01 0.11550000E+05 0.61142943 14.36896986 1.53607072 0.20176463E-01 0.11600000E+05 0.59741618 14.42207267 1.53613358 0.19838548E-01 0.11650000E+05 0.58335850 14.47401181 1.53623456 0.19490997E-01 0.11700000E+05 0.56927650 14.52480805 1.53630345 0.19135415E-01 0.11750000E+05 0.55518964 14.57448261 1.53629010 0.18773839E-01 0.11800000E+05 0.54111686 14.62305766 1.53619974 0.18408557E-01 0.11850000E+05 0.52707682 14.67055696 1.53609062 0.18042093E-01 0.11900000E+05 0.51308796 14.71700628 1.53603579 0.17677392E-01 0.11950000E+05 0.49916860 14.76243363 1.53607328 0.17318003E-01 0.12000000E+05 0.48533697 14.80686945 1.53617873 0.16967973E-01 0.12050000E+05 0.47161121 14.85034648 1.53628148 0.16631362E-01 0.12100000E+05 0.45800935 14.89289975 1.53631289 0.16311562E-01 0.12150000E+05 0.44454924 14.93456637 1.53625226 0.16010705E-01 0.12200000E+05 0.43124846 14.97538546 1.53614037 0.15729357E-01 0.12250000E+05 0.41812426 15.01539814 1.53605264 0.15466571E-01 0.12300000E+05 0.40519335 15.05464747 1.53604901 0.15220213E-01 0.12350000E+05 0.39247176 15.09317851 1.53613301 0.14987478E-01 0.12400000E+05 0.37997457 15.13103813 1.53624940 0.14765452E-01 0.12450000E+05 0.36771570 15.16827474 1.53632194 0.14551590E-01 0.12500000E+05 0.35570761 15.20493774 1.53630388 0.14344033E-01 0.12550000E+05 0.34396109 15.24107664 1.53620823 0.14141717E-01 0.12600000E+05 0.33248503 15.27674012 1.53609920 0.13944279E-01 0.12650000E+05 0.32128640 15.31197483 1.53605008 0.13751853E-01 0.12700000E+05 0.31037021 15.34682444 1.53609411 0.13564864E-01 0.12750000E+05 0.29973967 15.38132875 1.53620268 0.13383876E-01 0.12800000E+05 0.28939638 15.41552327 1.53630619 0.13209470E-01 0.12850000E+05 0.27934063 15.44943919 1.53634024 0.13042118E-01 0.12900000E+05 0.26957173 15.48310375 1.53628609 0.12882068E-01 0.12950000E+05 0.26008829 15.51654102 1.53618114 0.12729304E-01 0.13000000E+05 0.25088851 15.54977289 1.53609337 0.12583589E-01 0.13050000E+05 0.24197029 15.58282015 1.53607636 0.12444583E-01 0.13100000E+05 0.23333140 15.61570353 1.53613649 0.12311956E-01 0.13150000E+05 0.22496944 15.64844454 1.53623385 0.12185441E-01 0.13200000E+05 0.21688176 15.68106603 1.53631066 0.12064759E-01 0.13250000E+05 0.20906539 15.71359240 1.53632493 0.11949445E-01 0.13300000E+05 0.20151685 15.74604950 1.53627185 0.11838647E-01 0.13350000E+05 0.19423212 15.77846428 1.53618339 0.11731048E-01 0.13400000E+05 0.18720654 15.81086433 1.53610764 0.11624977E-01 0.13450000E+05 0.18043485 15.84327732 1.53608240 0.11518735E-01 0.13500000E+05 0.17391125 15.87573071 1.53611848 0.11411008E-01 0.13550000E+05 0.16762956 15.90825156 1.53619650 0.11301194E-01 0.13600000E+05 0.16158342 15.94086677 1.53627433 0.11189496E-01 0.13650000E+05 0.15576639 15.97360351 1.53630591 0.11076675E-01 0.13700000E+05 0.15017215 16.00648985 1.53626686 0.10963569E-01 0.13750000E+05 0.14479459 16.03955549 1.53617093 0.10850567E-01 0.13800000E+05 0.13962776 16.07283214 1.53606608 0.10737267E-01 0.13850000E+05 0.13466592 16.10635357 1.53601052 0.10622475E-01 0.13900000E+05 0.12990336 16.14015497 1.53603871 0.10504522E-01 0.13950000E+05 0.12533432 16.17427166 1.53613509 0.10381771E-01 0.14000000E+05 0.12095287 16.20873716 1.53623757 0.10253099E-01 0.14050000E+05 0.11675285 16.24358083 1.53627485 0.10118164E-01 0.14100000E+05 0.11272778 16.27882550 1.53621296 0.99774047E-02 0.14150000E+05 0.10887099 16.31448538 1.53607954 0.98317988E-02 0.14200000E+05 0.10517561 16.35056482 1.53595038 0.96825133E-02 0.14250000E+05 0.10163476 16.38705802 1.53590315 0.95305692E-02 0.14300000E+05 0.09824162 16.42394995 1.53596471 0.93766248E-02 0.14350000E+05 0.09498959 16.46121839 1.53608971 0.92209149E-02 0.14400000E+05 0.09187233 16.49883656 1.53618975 0.90633230E-02 0.14450000E+05 0.08888385 16.53677620 1.53619201 0.89035335E-02 0.14500000E+05 0.08601846 16.57501033 1.53608677 0.87412063E-02 0.14550000E+05 0.08327078 16.61351528 1.53593529 0.85761345E-02 0.14600000E+05 0.08063567 16.65227181 1.53583107 0.84083571E-02 0.14650000E+05 0.07810820 16.69126505 1.53583620 0.82382158E-02 0.14700000E+05 0.07568356 16.73048338 1.53593810 0.80663366E-02 0.14750000E+05 0.07335709 16.76991679 1.53606026 0.78935294E-02 0.14800000E+05 0.07112422 16.80955476 1.53611600 0.77206270E-02 0.14850000E+05 0.06898051 16.84938440 1.53606447 0.75483231E-02 0.14900000E+05 0.06692167 16.88938907 1.53593619 0.73770770E-02 0.14950000E+05 0.06494353 16.92954763 1.53581316 0.72071098E-02 0.15000000E+05 0.06304214 16.96983448 1.53577297 0.70384678E-02 0.15050000E+05 0.06121371 17.01022024 1.53583518 0.68710996E-02 0.15100000E+05 0.05945462 17.05067287 1.53595046 0.67049160E-02 0.15150000E+05 0.05776144 17.09115896 1.53603640 0.65398310E-02 0.15200000E+05 0.05613090 17.13164487 1.53603118 0.63758043E-02 0.15250000E+05 0.05455986 17.17209769 1.53593374 0.62128953E-02 0.15300000E+05 0.05304537 17.21248565 1.53580742 0.60513126E-02 0.15350000E+05 0.05158457 17.25277823 1.53573823 0.58914271E-02 0.15400000E+05 0.05017475 17.29294581 1.53577336 0.57337170E-02 0.15450000E+05 0.04881334 17.33295910 1.53588681 0.55786476E-02 0.15500000E+05 0.04749790 17.37278852 1.53599665 0.54265290E-02 0.15550000E+05 0.04622608 17.41240369 1.53602011 0.52774177E-02 0.15600000E+05 0.04499569 17.45177302 1.53593214 0.51311115E-02 0.15650000E+05 0.04380461 17.49086379 1.53578953 0.49872490E-02 0.15700000E+05 0.04265086 17.52964235 1.53569470 0.48454724E-02 0.15750000E+05 0.04153256 17.56807479 1.53571991 0.47055860E-02 0.15800000E+05 0.04044793 17.60612758 1.53585101 0.45676462E-02 0.15850000E+05 0.03939528 17.64376838 1.53599416 0.44319517E-02 0.15900000E+05 0.03837305 17.68096680 1.53604027 0.42989434E-02 0.15950000E+05 0.03737978 17.71769488 1.53594532 0.41690567E-02 0.16000000E+05 0.03641410 17.75392748 1.53577048 0.40425793E-02 0.16050000E+05 0.03547475 17.78964237 1.53564309 0.39195630E-02 0.16100000E+05 0.03456056 17.82482018 1.53566093 0.37998175E-02 0.16150000E+05 0.03367047 17.85944407 1.53581597 0.36829876E-02 0.16200000E+05 0.03280345 17.89349945 1.53599746 0.35686904E-02 0.16250000E+05 0.03195859 17.92697359 1.53606967 0.34566682E-02 0.16300000E+05 0.03113500 17.95985539 1.53597140 0.33468976E-02 0.16350000E+05 0.03033189 17.99213519 1.53576792 0.32396012E-02 0.16400000E+05 0.02954850 18.02380483 1.53560812 0.31351452E-02 0.16450000E+05 0.02878413 18.05485770 1.53561148 0.30338665E-02 0.16500000E+05 0.02803814 18.08528895 1.53577638 0.29359151E-02 0.16550000E+05 0.02730993 18.11509566 1.53598211 0.28411878E-02 0.16600000E+05 0.02659895 18.14427696 1.53607696 0.27493776E-02 0.16650000E+05 0.02590471 18.17283402 1.53598819 0.26601028E-02 0.16700000E+05 0.02522673 18.20076996 1.53577900 0.25730523E-02 0.16750000E+05 0.02456460 18.22808963 1.53560481 0.24880890E-02 0.16800000E+05 0.02391790 18.25479932 1.53559403 0.24052758E-02 0.16850000E+05 0.02328627 18.28090636 1.53574956 0.23248163E-02 0.16900000E+05 0.02266935 18.30641885 1.53595127 0.22469372E-02 0.16950000E+05 0.02206680 18.33134531 1.53604890 0.21717647E-02 0.17000000E+05 0.02147830 18.35569459 1.53597191 0.20992515E-02 0.17050000E+05 0.02090356 18.37947570 1.53578126 0.20291907E-02 0.17100000E+05 0.02034227 18.40269787 1.53562363 0.19613023E-02 0.17150000E+05 0.01979415 18.42537057 1.53561617 0.18953436E-02 0.17200000E+05 0.01925894 18.44750355 1.53575521 0.18311859E-02 0.17250000E+05 0.01873639 18.46910687 1.53592584 0.17688282E-02 0.17300000E+05 0.01822623 18.49019089 1.53599637 0.17083569E-02 0.17350000E+05 0.01772824 18.51076621 1.53591757 0.16498785E-02 0.17400000E+05 0.01724217 18.53084354 1.53575687 0.15934581E-02 0.17450000E+05 0.01676779 18.55043353 1.53564408 0.15390784E-02 0.17500000E+05 0.01630489 18.56954660 1.53566572 0.14866325E-02 0.17550000E+05 0.01585324 18.58819281 1.53579511 0.14359516E-02 0.17600000E+05 0.01541261 18.60638170 1.53592024 0.13868626E-02 0.17650000E+05 0.01498280 18.62412235 1.53593960 0.13392483E-02 0.17700000E+05 0.01456359 18.64142341 1.53584149 0.12930769E-02 0.17750000E+05 0.01415477 18.65829328 1.53570979 0.12483840E-02 0.17800000E+05 0.01375614 18.67474024 1.53565533 0.12052210E-02 0.17850000E+05 0.01336751 18.69077261 1.53572268 0.11636075E-02 0.17900000E+05 0.01298866 18.70639885 1.53585111 0.11235113E-02 0.17950000E+05 0.01261942 18.72162752 1.53592901 0.10848579E-02 0.18000000E+05 0.01225959 18.73646719 1.53589087 0.10475522E-02 0.18050000E+05 0.01190899 18.75092636 1.53576885 0.10115001E-02 0.18100000E+05 0.01156742 18.76501323 1.53566369 0.97662640E-03 0.18150000E+05 0.01123471 18.77873572 1.53566375 0.94288600E-03 0.18200000E+05 0.01091068 18.79210141 1.53577091 0.91026403E-03 0.18250000E+05 0.01059514 18.80511765 1.53589515 0.87876311E-03 0.18300000E+05 0.01028792 18.81779169 1.53593170 0.84838432E-03 0.18350000E+05 0.00998884 18.83013081 1.53585171 0.81911199E-03 0.18400000E+05 0.00969773 18.84214243 1.53572206 0.79090815E-03 0.18450000E+05 0.00941442 18.85383411 1.53564612 0.76371609E-03 0.18500000E+05 0.00913875 18.86521354 1.53568301 0.73747045E-03 0.18550000E+05 0.00887054 18.87628836 1.53580206 0.71211128E-03 0.18600000E+05 0.00860964 18.88706612 1.53590545 0.68759667E-03 0.18650000E+05 0.00835589 18.89755413 1.53590993 0.66390697E-03 0.18700000E+05 0.00810912 18.90775946 1.53581811 0.64103755E-03 0.18750000E+05 0.00786917 18.91768895 1.53570991 0.61898479E-03 0.18800000E+05 0.00763589 18.92734930 1.53566949 0.59773421E-03 0.18850000E+05 0.00740912 18.93674711 1.53572122 0.57725637E-03 0.18900000E+05 0.00718871 18.94588896 1.53581796 0.55751025E-03 0.18950000E+05 0.00697451 18.95478140 1.53587994 0.53845110E-03 0.19000000E+05 0.00676637 18.96343097 1.53586019 0.52003953E-03 0.19050000E+05 0.00656415 18.97184406 1.53578465 0.50224838E-03 0.19100000E+05 0.00636770 18.98002691 1.53572369 0.48506375E-03 0.19150000E+05 0.00617688 18.98798551 1.53572435 0.46847948E-03 0.19200000E+05 0.00599155 18.99572560 1.53577536 0.45248856E-03 0.19250000E+05 0.00581158 19.00325268 1.53582719 0.43707699E-03 0.19300000E+05 0.00563682 19.01057208 1.53583527 0.42222209E-03 0.19350000E+05 0.00546714 19.01768900 1.53579589 0.40789424E-03 0.19400000E+05 0.00530242 19.02460856 1.53575079 0.39406094E-03 0.19450000E+05 0.00514251 19.03133583 1.53574714 0.38069295E-03 0.19500000E+05 0.00498731 19.03787578 1.53578824 0.36777117E-03 0.19550000E+05 0.00483668 19.04423333 1.53583192 0.35528968E-03 0.19600000E+05 0.00469050 19.05041322 1.53583528 0.34325092E-03 0.19650000E+05 0.00454865 19.05642002 1.53579269 0.33165490E-03 0.19700000E+05 0.00441102 19.06225813 1.53573912 0.32048992E-03 0.19750000E+05 0.00427748 19.06793171 1.53572401 0.30973151E-03 0.19800000E+05 0.00414794 19.07344478 1.53576817 0.29934981E-03 0.19850000E+05 0.00402227 19.07880116 1.53583770 0.28931902E-03 0.19900000E+05 0.00390038 19.08400453 1.53587148 0.27962281E-03 0.19950000E+05 0.00378214 19.08905844 1.53583945 0.27025367E-03 0.20000000E+05 0.00366747 19.09396630 1.53576753 0.26120903E-03 warning: ndused not equal to ndatus ************************************************************************ info from reading or writing asymptotic info ************************************************************************ # timesteps for which bk coefs available is: 400 # data used, ndused = 396 effective prop.time, spectral resolution (mev) = 19800.0000 0.4317532E+01 meaningful results in kin energy range (ev) 0.004318 1.709743 results will be obtained for nen95 energies,nen95 = 93 ************************************************************************ info from gtaife ************************************************************************ ************************************************************************ info from probaf ************************************************************************ # of data skipped in between data in next printout = 0 idat ekin(ev) preact phase 1 0.1511136 -0.005788 2.48144 2 0.1554312 -0.016707 1.94107 3 0.1597487 -0.016243 1.42621 4 0.1640662 -0.007289 0.92569 5 0.1683837 0.003292 0.42795 6 0.1727013 0.009121 -0.07366 7 0.1770188 0.007945 -0.57571 8 0.1813363 0.002250 -1.06547 9 0.1856539 -0.003243 -1.53100 10 0.1899714 -0.005076 -1.97132 11 0.1942889 -0.003010 -2.39692 12 0.1986065 0.000596 -2.82237 13 0.2029240 0.002973 3.02715 14 0.2072415 0.002820 2.59144 15 0.2115591 0.000763 2.17033 16 0.2158766 -0.001424 1.77367 17 0.2201941 -0.002096 1.39454 18 0.2245117 -0.000831 1.01613 19 0.2288292 0.001212 0.62727 20 0.2331467 0.002109 0.23509 21 0.2374643 0.000903 -0.14109 22 0.2417818 -0.001239 -0.49297 23 0.2460993 -0.001971 -0.83244 24 0.2504169 -0.000350 -1.17767 25 0.2547344 0.001787 -1.53237 26 0.2590519 0.001772 -1.87935 27 0.2633695 -0.000511 -2.20229 28 0.2676870 -0.002156 -2.50692 29 0.2720045 -0.000875 -2.81258 30 0.2763221 0.001727 -3.12817 31 0.2806396 0.002034 2.84361 32 0.2849571 -0.000548 2.55434 33 0.2892746 -0.002426 2.28350 34 0.2935922 -0.000795 2.01172 35 0.2979097 0.002059 1.72976 36 0.3022272 0.001834 1.45200 37 0.3065448 -0.001298 1.19536 38 0.3108623 -0.002617 0.95388 39 0.3151798 0.000021 0.70800 40 0.3194974 0.002579 0.45257 41 0.3238149 0.000942 0.20532 42 0.3281324 -0.002393 -0.02085 43 0.3324500 -0.002018 -0.23790 44 0.3367675 0.001581 -0.46393 45 0.3410850 0.002514 -0.69538 46 0.3454026 -0.000865 -0.91200 47 0.3497201 -0.002944 -1.11037 48 0.3540376 -0.000137 -1.30903 49 0.3583552 0.002823 -1.51893 50 0.3626727 0.000776 -1.72501 51 0.3669902 -0.002821 -1.91149 52 0.3713078 -0.001664 -2.08896 53 0.3756253 0.002284 -2.27667 54 0.3799428 0.002024 -2.47032 55 0.3842604 -0.002022 -2.64872 56 0.3885779 -0.002554 -2.81164 57 0.3928954 0.001466 -2.98026 58 0.3972129 0.002763 3.12249 59 0.4015305 -0.000989 2.95118 60 0.4058480 -0.002733 2.79890 61 0.4101655 0.000957 2.64632 62 0.4144831 0.003371 2.47936 63 0.4188006 0.000182 2.31603 64 0.4231181 -0.002299 2.17357 65 0.4274357 0.000975 2.03578 66 0.4317532 0.004115 1.88289 67 0.4360707 0.001583 1.72950 68 0.4403883 -0.001048 1.59806 69 0.4447058 0.002181 1.47535 70 0.4490233 0.005990 1.33768 71 0.4533409 0.004162 1.19741 72 0.4576584 0.001814 1.08102 73 0.4619759 0.005401 0.97600 74 0.4662935 0.009945 0.85227 75 0.4706110 0.008721 0.71774 76 0.4749285 0.006315 0.60312 77 0.4792461 0.009331 0.49818 78 0.4835636 0.013557 0.37210 79 0.4878811 0.013034 0.23994 80 0.4921987 0.012159 0.13803 81 0.4965162 0.016366 0.04864 82 0.5008337 0.020983 -0.06566 83 0.5051512 0.021149 -0.18479 84 0.5094688 0.021918 -0.26969 85 0.5137863 0.027455 -0.34879 86 0.5181038 0.031988 -0.46656 87 0.5224214 0.031585 -0.58916 88 0.5267389 0.032293 -0.66986 89 0.5310564 0.037737 -0.75305 90 0.5353740 0.042203 -0.88400 91 0.5396915 0.043205 -1.00078 92 0.5440090 0.046501 -1.06503 93 0.5483266 0.053436 -1.15636 ******************************************************************************** PRINTING SCATTERING AND REACTION PROBABILITIES ******************************************************************************** etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.150000 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41843953D+01 trans energy = 0.20714286D+00 trans energy in z = 0.20714286D+00 total momentum = 0.74792309D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9971741E+00 0.1183411E-01 0.4948078E+00 1 0.2398563E-05 0.1596277E-01 0.6358398E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.2826668E-06 0 31 2 -2 0.4260386E-07 0 37 2 -1 0.1862963E-06 0 44 2 0 0.2751887E-06 0 50 2 1 0.1398810E-05 0 56 2 2 0.8025303E-06 0 21 4 -4 0.4170160E-08 0 26 4 -3 0.1148358E-07 0 32 4 -2 0.4648176E-07 0 38 4 -1 0.1302906E-06 0 45 4 0 0.9021008E-06 0 51 4 1 0.2658591E-05 0 57 4 2 0.9393853E-05 0 62 4 3 0.9530152E-05 0 67 4 4 0.3055577E-05 0 13 6 -6 0.7556387E-10 0 17 6 -5 0.2723915E-09 0 22 6 -4 0.8712181E-09 0 27 6 -3 0.7780332E-08 0 33 6 -2 0.6978010E-08 0 39 6 -1 0.2155660E-06 0 46 6 0 0.3481707E-06 0 52 6 1 0.8105327E-05 0 58 6 2 0.2577745E-04 0 63 6 3 0.2691059E-03 0 68 6 4 0.3806101E-03 0 72 6 5 0.2686630E-03 0 76 6 6 0.6363430E-04 0 7 8 -8 0.1139343E-11 0 10 8 -7 0.2012154E-11 0 14 8 -6 0.2527851E-11 0 18 8 -5 0.1369130E-10 0 23 8 -4 0.4122930E-10 0 28 8 -3 0.1560161E-08 0 34 8 -2 0.8478974E-08 0 40 8 -1 0.2183884E-06 0 47 8 0 0.3114296E-06 0 53 8 1 0.1545214E-04 0 59 8 2 0.1523951E-03 0 64 8 3 0.4780555E-02 0 69 8 4 0.7055496E-01 0 73 8 5 0.8215711E+00 0 77 8 6 0.9354877E-01 0 80 8 7 0.5412662E-02 0 83 8 8 0.9243089E-04 0 3 10 -10 0.0000000E+00 0 5 10 -9 0.0000000E+00 0 8 10 -8 0.0000000E+00 0 11 10 -7 0.0000000E+00 0 15 10 -6 0.0000000E+00 0 19 10 -5 0.0000000E+00 0 24 10 -4 0.0000000E+00 0 29 10 -3 0.0000000E+00 0 35 10 -2 0.0000000E+00 0 41 10 -1 0.0000000E+00 0 48 10 0 0.0000000E+00 0 54 10 1 0.0000000E+00 0 60 10 2 0.0000000E+00 0 65 10 3 0.0000000E+00 0 70 10 4 0.0000000E+00 0 74 10 5 0.0000000E+00 0 78 10 6 0.0000000E+00 0 81 10 7 0.0000000E+00 0 84 10 8 0.0000000E+00 0 86 10 9 0.0000000E+00 0 88 10 10 0.0000000E+00 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.2742744E-07 1 31 2 -2 0.9589091E-09 1 37 2 -1 0.6696864E-08 1 44 2 0 0.2444637E-07 1 50 2 1 0.5052025E-06 1 56 2 2 0.1332453E-05 1 21 4 -4 0.6243339E-12 1 26 4 -3 0.9695890E-11 1 32 4 -2 0.1503969E-10 1 38 4 -1 0.2635587E-07 1 45 4 0 0.1741465E-08 1 51 4 1 0.3326143E-07 1 57 4 2 0.8986779E-07 1 62 4 3 0.1776767E-06 1 67 4 4 0.1724500E-06 1 13 6 -6 0.0000000E+00 1 17 6 -5 0.0000000E+00 1 22 6 -4 0.0000000E+00 1 27 6 -3 0.0000000E+00 1 33 6 -2 0.0000000E+00 1 39 6 -1 0.0000000E+00 1 46 6 0 0.0000000E+00 1 52 6 1 0.0000000E+00 1 58 6 2 0.0000000E+00 1 63 6 3 0.0000000E+00 1 68 6 4 0.0000000E+00 1 72 6 5 0.0000000E+00 1 76 6 6 0.0000000E+00 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.2019170E-16 1 0.2424087E-08 2 0.4252370E-07 3 0.1342294E-06 4 0.4190346E-07 5 0.2659756E-07 6 0.1413273E-07 7 0.1336398E-07 8 0.6314389E-08 9 0.1177448E-08 v, j, mj = 0 2 -2 0 0.5765967E-16 1 0.7736067E-09 2 0.2930242E-08 3 0.4640088E-08 4 0.6690847E-08 5 0.1201318E-07 6 0.8813243E-08 7 0.2737832E-08 8 0.2474884E-08 9 0.1529936E-08 v, j, mj = 0 2 -1 0 0.2252112E-08 1 0.1027675E-08 2 0.1308333E-07 3 0.6918311E-07 4 0.4419361E-07 5 0.2341291E-07 6 0.1081212E-07 7 0.1084412E-07 8 0.8405083E-08 9 0.3082273E-08 v, j, mj = 0 2 0 0 0.1378565E-15 1 0.3352045E-08 2 0.2484596E-07 3 0.9904347E-07 4 0.4209019E-07 5 0.2922192E-07 6 0.5063185E-07 7 0.1977904E-07 8 0.5578638E-08 9 0.6455506E-09 v, j, mj = 0 2 1 0 0.3058209E-15 1 0.7295780E-08 2 0.5330753E-06 3 0.4328266E-06 4 0.8558301E-07 5 0.1676570E-06 6 0.1024668E-06 7 0.5952095E-07 8 0.8548063E-08 9 0.1836145E-08 v, j, mj = 0 2 2 0 0.1191808E-08 1 0.7452349E-07 2 0.3642272E-06 3 0.1289681E-06 4 0.5153369E-07 5 0.8928622E-07 6 0.7677044E-07 7 0.1211220E-07 8 0.2997477E-08 9 0.9197261E-09 v, j, mj = 0 4 -4 0 0.4493029E-10 1 0.4801949E-09 2 0.1687161E-09 3 0.3925102E-09 4 0.2368541E-09 5 0.2913257E-09 6 0.2487698E-09 7 0.7773281E-09 8 0.9770975E-09 9 0.5524331E-09 v, j, mj = 0 4 -3 0 0.1780370E-15 1 0.6493149E-09 2 0.1356651E-08 3 0.1044935E-08 4 0.5644538E-09 5 0.9861716E-09 6 0.8134058E-09 7 0.1999531E-08 8 0.2296017E-08 9 0.1773096E-08 v, j, mj = 0 4 -2 0 0.6741625E-16 1 0.1424954E-08 2 0.8169824E-08 3 0.4104911E-08 4 0.6135068E-08 5 0.4679018E-08 6 0.6095131E-08 7 0.8516328E-08 8 0.5524178E-08 9 0.1832343E-08 v, j, mj = 0 4 -1 0 0.3797626E-10 1 0.3525214E-09 2 0.8338765E-08 3 0.4262538E-07 4 0.3019258E-07 5 0.2117916E-07 6 0.1838793E-07 7 0.7048249E-08 8 0.1679011E-08 9 0.4490571E-09 v, j, mj = 0 4 0 0 0.5312114E-16 1 0.1448433E-07 2 0.1276916E-06 3 0.4117464E-06 4 0.1763150E-06 5 0.4309391E-07 6 0.8059500E-07 7 0.3079727E-07 8 0.1417723E-07 9 0.3199997E-08 v, j, mj = 0 4 1 0 0.1050810E-15 1 0.3875541E-07 2 0.7683709E-06 3 0.1178261E-05 4 0.4605387E-06 5 0.1003109E-06 6 0.9575728E-07 7 0.1016318E-07 8 0.3439771E-08 9 0.2993913E-08 v, j, mj = 0 4 2 0 0.3081529E-08 1 0.5064800E-06 2 0.5096441E-05 3 0.1977603E-05 4 0.1019241E-05 5 0.4154567E-06 6 0.3039643E-06 7 0.6202257E-07 8 0.8769959E-08 9 0.7925999E-09 v, j, mj = 0 4 3 0 0.1104398E-14 1 0.4510549E-05 2 0.3979547E-05 3 0.5168540E-06 4 0.2823712E-06 5 0.1504553E-06 6 0.7336569E-07 7 0.1329246E-07 8 0.2735687E-08 9 0.9817831E-09 v, j, mj = 0 4 4 0 0.2962134E-15 1 0.1172650E-05 2 0.9612962E-06 3 0.5969100E-06 4 0.1963093E-06 5 0.9140517E-07 6 0.2386330E-07 7 0.1140034E-07 8 0.1306702E-08 9 0.4356237E-09 v, j, mj = 0 6 -6 0 0.7396195E-16 1 0.8270937E-13 2 0.8018407E-12 3 0.2344706E-11 4 0.1621929E-11 5 0.5676814E-11 6 0.1759731E-10 7 0.3176234E-10 8 0.1567614E-10 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2154512E-15 1 0.5295333E-12 2 0.1484455E-10 3 0.1310490E-10 4 0.2121155E-10 5 0.3322338E-10 6 0.4954458E-10 7 0.1386146E-09 8 0.1318168E-11 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.6878172E-11 1 0.2653432E-10 2 0.8458149E-10 3 0.1561606E-09 4 0.9549423E-10 5 0.1082979E-09 6 0.1593437E-09 7 0.2183192E-09 8 0.1560846E-10 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.3191211E-15 1 0.5774944E-09 2 0.1258833E-08 3 0.6393218E-09 4 0.9658907E-09 5 0.1052404E-08 6 0.1308390E-08 7 0.1956690E-08 8 0.2130786E-10 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.2715258E-15 1 0.1543419E-08 2 0.3934940E-09 3 0.8733525E-09 4 0.1714113E-08 5 0.1345154E-08 6 0.6052780E-09 7 0.4888638E-09 8 0.1433598E-10 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.2569309E-07 1 0.1759021E-07 2 0.3750147E-07 3 0.2636373E-07 4 0.4055417E-07 5 0.3854382E-07 6 0.1841782E-07 7 0.1081273E-07 8 0.8894761E-10 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.6409819E-16 1 0.2164197E-07 2 0.3201188E-07 3 0.2116586E-06 4 0.5977599E-07 5 0.6478076E-08 6 0.1366243E-07 7 0.2914871E-08 8 0.2686522E-10 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.3283375E-14 1 0.1994518E-06 2 0.3815769E-05 3 0.1947672E-05 4 0.1642837E-05 5 0.3928739E-06 6 0.8813635E-07 7 0.1850779E-07 8 0.7968448E-10 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.5338051E-07 1 0.1181055E-05 2 0.1290063E-04 3 0.1018647E-04 4 0.1287217E-05 5 0.1191447E-06 6 0.3968536E-07 7 0.9498584E-08 8 0.3572334E-09 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.1189979E-13 1 0.8494020E-04 2 0.1135281E-03 3 0.6428748E-04 4 0.5195440E-05 5 0.1072928E-05 6 0.5939447E-07 7 0.2168294E-07 8 0.7055341E-09 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.2744661E-15 1 0.7090468E-04 2 0.1749271E-03 3 0.1199776E-03 4 0.1451590E-04 5 0.2100701E-06 6 0.5476914E-07 7 0.1967934E-07 8 0.3544910E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.9066425E-04 1 0.1316712E-03 2 0.1811238E-04 3 0.1677988E-04 4 0.1022674E-04 5 0.1191873E-05 6 0.1198167E-07 7 0.4494771E-08 8 0.1637354E-09 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.9119508E-16 1 0.2407952E-04 2 0.1911815E-04 3 0.1286902E-04 4 0.7099413E-05 5 0.4313236E-06 6 0.2796719E-07 7 0.8583909E-08 8 0.3268617E-09 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.6777591E-17 1 0.6441800E-13 2 0.1541375E-12 3 0.1055018E-12 4 0.3291972E-12 5 0.4860820E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.5827121E-14 1 0.2049156E-13 2 0.7090934E-13 3 0.1023989E-12 4 0.4706993E-12 5 0.1341828E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.9934686E-17 1 0.1846795E-13 2 0.5118759E-13 3 0.1667100E-12 4 0.3310447E-12 5 0.1960430E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1288750E-16 1 0.5018135E-13 2 0.1399513E-12 3 0.3321129E-12 4 0.4953118E-11 5 0.8215923E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1252218E-12 1 0.6608021E-12 2 0.1657566E-11 3 0.3637495E-11 4 0.2413411E-10 5 0.1101411E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1087207E-16 1 0.4432280E-10 2 0.4519076E-10 3 0.1797280E-09 4 0.8506251E-09 5 0.4402944E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3277794E-17 1 0.8176992E-09 2 0.2792275E-08 3 0.2464920E-08 4 0.1136668E-08 5 0.1267412E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2022521E-07 1 0.2533621E-07 2 0.7753066E-07 3 0.1988612E-07 4 0.5769670E-07 5 0.1771355E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.3102500E-19 1 0.1054910E-06 2 0.1211003E-06 3 0.1763685E-07 4 0.3116103E-07 5 0.3604035E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1958719E-16 1 0.4063676E-05 2 0.7578224E-05 3 0.2219455E-05 4 0.1367502E-05 5 0.2232880E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.3577632E-06 1 0.2106889E-04 2 0.1050114E-03 3 0.2482717E-04 4 0.1012800E-05 5 0.1171153E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2618241E-15 1 0.1778192E-02 2 0.2648062E-02 3 0.3403507E-03 4 0.1372600E-04 5 0.2240981E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.8078672E-17 1 0.3896643E-01 2 0.2914348E-01 3 0.2411212E-02 4 0.3368673E-04 5 0.1493196E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1770767E+00 1 0.4964705E+00 2 0.1426443E+00 3 0.5329256E-02 4 0.4989677E-04 5 0.4182507E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1186393E-16 1 0.3747213E-01 2 0.5025263E-01 3 0.5741083E-02 4 0.8266946E-04 5 0.2645765E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2709763E-15 1 0.2846644E-03 2 0.4023060E-02 3 0.1070851E-02 4 0.3385307E-04 5 0.2328859E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1270091E-06 1 0.9874139E-06 2 0.5157506E-04 3 0.3774484E-04 4 0.1888755E-05 5 0.1078146E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.2350967E-16 1 0.2279206E-08 2 0.5826591E-08 3 0.8516926E-08 4 0.2977501E-08 5 0.7827211E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.8187160E-17 1 0.3720385E-10 2 0.1193872E-10 3 0.3444740E-10 4 0.8753191E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2036403E-08 1 0.3732500E-09 2 0.1111334E-08 3 0.6156498E-09 4 0.2560227E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.7382292E-17 1 0.1883329E-08 2 0.6118611E-08 3 0.2427971E-08 4 0.1401646E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1631890E-16 1 0.3175942E-06 2 0.1232183E-06 3 0.2347417E-07 4 0.4091588E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.9745838E-09 1 0.1185440E-05 2 0.8613289E-07 3 0.4677542E-07 4 0.1313002E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2228554E-13 1 0.3687174E-12 2 0.2333310E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2744068E-18 1 0.2652390E-11 2 0.7043500E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.5758314E-19 1 0.4995319E-11 2 0.1004437E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.5620720E-08 1 0.1526922E-07 2 0.5465935E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.1201799E-18 1 0.2958565E-09 2 0.1445608E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.2399075E-18 1 0.1973985E-07 2 0.1352158E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1527003E-08 1 0.8389631E-07 2 0.4444483E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.7771056E-19 1 0.1338638E-06 2 0.4381286E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1488217E-18 1 0.1596253E-06 2 0.1282470E-07 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9971765 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.494807 average diffraction energy (ev) = 0.011834 the reaction probability = 0.2823539D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.41272524D+01 trans energy = 0.26428571D+00 trans energy in z = 0.26428571D+00 total momentum = 0.84480953D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1000848E+01 0.1836041E-01 0.4943017E+00 1 0.1156933E-04 0.1793285E-01 0.1033800E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1929197E-05 0 31 2 -2 0.1308089E-06 0 37 2 -1 0.1117978E-05 0 44 2 0 0.1119812E-05 0 50 2 1 0.8038724E-05 0 56 2 2 0.3549187E-05 0 21 4 -4 0.6157976E-08 0 26 4 -3 0.3766277E-07 0 32 4 -2 0.2820453E-06 0 38 4 -1 0.1063486E-05 0 45 4 0 0.5827774E-05 0 51 4 1 0.1520198E-04 0 57 4 2 0.3720530E-04 0 62 4 3 0.4882570E-04 0 67 4 4 0.1165413E-04 0 13 6 -6 0.1513021E-09 0 17 6 -5 0.7622627E-09 0 22 6 -4 0.2166629E-08 0 27 6 -3 0.1030726E-07 0 33 6 -2 0.2716416E-07 0 39 6 -1 0.7238663E-06 0 46 6 0 0.3401050E-05 0 52 6 1 0.4449711E-04 0 58 6 2 0.2020901E-03 0 63 6 3 0.1037223E-02 0 68 6 4 0.1153058E-02 0 72 6 5 0.7281423E-03 0 76 6 6 0.1889864E-03 0 7 8 -8 0.7287616E-11 0 10 8 -7 0.4554604E-11 0 14 8 -6 0.9673478E-11 0 18 8 -5 0.3202693E-10 0 23 8 -4 0.1514433E-09 0 28 8 -3 0.2486876E-08 0 34 8 -2 0.2035673E-07 0 40 8 -1 0.2755214E-06 0 47 8 0 0.1337368E-05 0 53 8 1 0.4282887E-04 0 59 8 2 0.7642081E-03 0 64 8 3 0.1233970E-01 0 69 8 4 0.1386014E+00 0 73 8 5 0.6314106E+00 0 77 8 6 0.1840774E+00 0 80 8 7 0.2864434E-01 0 83 8 8 0.1470944E-02 0 3 10 -10 0.2898347E-14 0 5 10 -9 0.3354798E-14 0 8 10 -8 0.1253995E-13 0 11 10 -7 0.3837558E-13 0 15 10 -6 0.1013457E-13 0 19 10 -5 0.6002532E-14 0 24 10 -4 0.1624174E-12 0 29 10 -3 0.2763911E-11 0 35 10 -2 0.6696090E-10 0 41 10 -1 0.8320309E-09 0 48 10 0 0.3045161E-10 0 54 10 1 0.6039449E-09 0 60 10 2 0.4513291E-08 0 65 10 3 0.5362612E-07 0 70 10 4 0.1818383E-06 0 74 10 5 0.4325479E-06 0 78 10 6 0.3661891E-06 0 81 10 7 0.1340935E-06 0 84 10 8 0.1347183E-07 0 86 10 9 0.2733093E-08 0 88 10 10 0.3154933E-09 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.8615343E-07 1 31 2 -2 0.3116391E-08 1 37 2 -1 0.2299555E-07 1 44 2 0 0.4623533E-07 1 50 2 1 0.1111260E-05 1 56 2 2 0.3273232E-05 1 21 4 -4 0.2114390E-10 1 26 4 -3 0.1269018E-09 1 32 4 -2 0.6719921E-09 1 38 4 -1 0.1798738E-07 1 45 4 0 0.1392025E-07 1 51 4 1 0.1047323E-06 1 57 4 2 0.1278025E-06 1 62 4 3 0.2064443E-05 1 67 4 4 0.4696627E-05 1 13 6 -6 0.0000000E+00 1 17 6 -5 0.0000000E+00 1 22 6 -4 0.0000000E+00 1 27 6 -3 0.0000000E+00 1 33 6 -2 0.0000000E+00 1 39 6 -1 0.0000000E+00 1 46 6 0 0.0000000E+00 1 52 6 1 0.0000000E+00 1 58 6 2 0.0000000E+00 1 63 6 3 0.0000000E+00 1 68 6 4 0.0000000E+00 1 72 6 5 0.0000000E+00 1 76 6 6 0.0000000E+00 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.3140661E-15 1 0.1365797E-07 2 0.3634984E-06 3 0.1230747E-05 4 0.2269577E-06 5 0.4156026E-07 6 0.1700467E-07 7 0.1894946E-07 8 0.1206649E-07 9 0.4754539E-08 v, j, mj = 0 2 -2 0 0.1611708E-14 1 0.2384298E-08 2 0.4401834E-08 3 0.4114320E-07 4 0.4511256E-07 5 0.1597168E-07 6 0.1371383E-07 7 0.2397263E-08 8 0.3126690E-08 9 0.2557583E-08 v, j, mj = 0 2 -1 0 0.6004109E-08 1 0.1236726E-07 2 0.8449163E-07 3 0.6497431E-06 4 0.3086012E-06 5 0.2791577E-07 6 0.1199026E-07 7 0.7653379E-08 8 0.5844235E-08 9 0.3366623E-08 v, j, mj = 0 2 0 0 0.5657481E-15 1 0.1498891E-07 2 0.1442395E-06 3 0.6634657E-06 4 0.2016305E-06 5 0.2654653E-07 6 0.4918384E-07 7 0.1284490E-07 8 0.5455775E-08 9 0.1456524E-08 v, j, mj = 0 2 1 0 0.8036553E-15 1 0.2068918E-06 2 0.3765849E-05 3 0.3687684E-05 4 0.1154272E-06 5 0.1235997E-06 6 0.8511253E-07 7 0.4456626E-07 8 0.6372571E-08 9 0.3220948E-08 v, j, mj = 0 2 2 0 0.4370538E-09 1 0.3699132E-06 2 0.2587508E-05 3 0.1502753E-06 4 0.1714710E-06 5 0.1583468E-06 6 0.7934723E-07 7 0.2400587E-07 8 0.6893058E-08 9 0.9892308E-09 v, j, mj = 0 4 -4 0 0.2037337E-09 1 0.4509083E-09 2 0.1299403E-08 3 0.5821481E-09 4 0.5010704E-09 5 0.3981327E-09 6 0.4022875E-09 7 0.8116430E-09 8 0.7049473E-09 9 0.8037021E-09 v, j, mj = 0 4 -3 0 0.1779805E-14 1 0.5921817E-08 2 0.2516464E-08 3 0.9310146E-08 4 0.9559868E-08 5 0.1757225E-08 6 0.1335635E-08 7 0.2759401E-08 8 0.2540434E-08 9 0.1961782E-08 v, j, mj = 0 4 -2 0 0.2410713E-15 1 0.1310650E-07 2 0.2448176E-07 3 0.1023054E-06 4 0.9434520E-07 5 0.2536386E-07 6 0.9388466E-08 7 0.8604842E-08 8 0.3215456E-08 9 0.1233837E-08 v, j, mj = 0 4 -1 0 0.6364582E-08 1 0.3462398E-08 2 0.6757672E-07 3 0.5148547E-06 4 0.3501308E-06 5 0.7722487E-07 6 0.3250574E-07 7 0.8171372E-08 8 0.2261465E-08 9 0.9332482E-09 v, j, mj = 0 4 0 0 0.6762559E-15 1 0.2066552E-07 2 0.1564563E-05 3 0.3273452E-05 4 0.7476265E-06 5 0.6586969E-07 6 0.1279981E-06 7 0.1812771E-07 8 0.7551265E-08 9 0.1919748E-08 v, j, mj = 0 4 1 0 0.1185434E-14 1 0.9219309E-07 2 0.5419428E-05 3 0.8343687E-05 4 0.1069678E-05 5 0.1502160E-06 6 0.9895247E-07 7 0.1904882E-07 8 0.6265105E-08 9 0.2507227E-08 v, j, mj = 0 4 2 0 0.2812932E-07 1 0.4427720E-05 2 0.2850800E-04 3 0.2162774E-05 4 0.1351721E-05 5 0.4545517E-06 6 0.2064684E-06 7 0.5808255E-07 8 0.6283162E-08 9 0.1565416E-08 v, j, mj = 0 4 3 0 0.8680198E-14 1 0.2607421E-04 2 0.1895463E-04 3 0.2216869E-05 4 0.1066849E-05 5 0.2993300E-06 6 0.1758640E-06 7 0.3103139E-07 8 0.4643243E-08 9 0.2269418E-08 v, j, mj = 0 4 4 0 0.1203989E-14 1 0.4682131E-05 2 0.3644199E-05 3 0.1721421E-05 4 0.1082998E-05 5 0.3859189E-06 6 0.1141888E-06 7 0.1777114E-07 8 0.4505823E-08 9 0.9998616E-09 v, j, mj = 0 6 -6 0 0.1319532E-14 1 0.2872559E-11 2 0.7004494E-11 3 0.1181075E-10 4 0.1187283E-10 5 0.8213240E-11 6 0.1224222E-10 7 0.3180353E-10 8 0.6548119E-10 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.4244602E-14 1 0.9200749E-11 2 0.9534285E-10 3 0.4531738E-10 4 0.6380964E-10 5 0.1181344E-09 6 0.8851796E-10 7 0.2729489E-09 8 0.6898657E-10 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.1298545E-10 1 0.3524775E-09 2 0.3611816E-09 3 0.3124292E-09 4 0.1512913E-09 5 0.9386899E-10 6 0.1441325E-09 7 0.3915934E-09 8 0.3466689E-09 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.3125950E-14 1 0.9866299E-09 2 0.1463340E-08 3 0.1253731E-08 4 0.9306156E-09 5 0.1733319E-08 6 0.2093853E-08 7 0.1558461E-08 8 0.2873022E-09 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.1643003E-14 1 0.2989119E-08 2 0.2003791E-08 3 0.9175524E-08 4 0.7970186E-08 5 0.2731390E-08 6 0.7262674E-09 7 0.9645484E-09 8 0.6033311E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.4689802E-07 1 0.2702774E-07 2 0.1360160E-06 3 0.3237920E-06 4 0.1232660E-06 5 0.4292101E-07 6 0.1745667E-07 7 0.5214393E-08 8 0.1274465E-08 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.1674521E-14 1 0.3517003E-07 2 0.6767562E-06 3 0.2138645E-05 4 0.5067033E-06 5 0.2223691E-07 6 0.1560571E-07 7 0.5389524E-08 8 0.5432866E-09 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.6286123E-13 1 0.4502464E-05 2 0.2091205E-04 3 0.1412332E-04 4 0.4668536E-05 5 0.2188720E-06 6 0.5697330E-07 7 0.5876489E-08 8 0.9016430E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.1159105E-06 1 0.8747529E-05 2 0.1083865E-03 3 0.7313504E-04 4 0.1089196E-04 5 0.7045029E-06 6 0.8769855E-07 7 0.1319195E-07 8 0.7804893E-08 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.1451737E-12 1 0.3397484E-03 2 0.3765796E-03 3 0.2915887E-03 4 0.2735436E-04 5 0.1816832E-05 6 0.1207623E-06 7 0.1251022E-07 8 0.1951775E-08 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.3862276E-14 1 0.4022349E-03 2 0.3682557E-03 3 0.3418210E-03 4 0.3936238E-04 5 0.1234256E-05 6 0.9911374E-07 7 0.3330641E-07 8 0.1775789E-07 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.1460841E-03 1 0.3159611E-03 2 0.5268079E-04 3 0.1149356E-03 4 0.8701651E-04 5 0.1114483E-04 6 0.2984923E-06 7 0.1728919E-07 8 0.3540237E-08 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.2251588E-14 1 0.6454085E-04 2 0.9714632E-04 3 0.1890582E-04 4 0.8161603E-05 5 0.1858539E-06 6 0.3184156E-07 7 0.9531263E-08 8 0.4540134E-08 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.5504242E-15 1 0.3509233E-13 2 0.9948313E-13 3 0.3014763E-12 4 0.4907809E-12 5 0.2361329E-11 6 0.3998904E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.3183075E-13 1 0.1711872E-12 2 0.1151417E-12 3 0.1378567E-12 4 0.6626027E-12 5 0.1328320E-11 6 0.2107665E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.9618729E-15 1 0.1688362E-12 2 0.1546263E-12 3 0.1115721E-12 4 0.1442450E-11 5 0.3408793E-11 6 0.4386238E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.9161137E-15 1 0.5802339E-12 2 0.3918319E-12 3 0.2939228E-11 4 0.3796626E-11 5 0.1605797E-10 6 0.8260120E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.8250668E-12 1 0.4681503E-11 2 0.9544079E-11 3 0.8148365E-11 4 0.3237148E-10 5 0.5824152E-10 6 0.3763127E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.4354350E-15 1 0.7360152E-10 2 0.1316170E-09 3 0.7765919E-09 4 0.1065167E-08 5 0.2886331E-09 6 0.1512648E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1398683E-15 1 0.7361693E-09 2 0.4059379E-08 3 0.8827863E-08 4 0.1801092E-08 5 0.4012254E-08 6 0.9199687E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2943626E-07 1 0.2715030E-07 2 0.9318939E-07 3 0.5687116E-07 4 0.5730475E-07 5 0.6521910E-08 6 0.5047671E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.2238166E-16 1 0.2536443E-06 2 0.5696609E-06 3 0.2847909E-06 4 0.9961141E-07 5 0.1160745E-06 6 0.1358641E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2052322E-14 1 0.6863909E-05 2 0.2147214E-04 3 0.1292351E-04 4 0.1448220E-05 5 0.8168467E-07 6 0.3940409E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.5233366E-06 1 0.8235814E-04 2 0.4834634E-03 3 0.1878149E-03 4 0.9470075E-05 5 0.5293086E-06 6 0.4901856E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2146689E-13 1 0.1938882E-02 2 0.8370240E-02 3 0.1943103E-02 4 0.8711026E-04 5 0.3247912E-06 6 0.4527058E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3744620E-15 1 0.5917892E-01 2 0.7015921E-01 3 0.9013699E-02 4 0.2480065E-03 5 0.1504127E-05 6 0.1997974E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1121359E+00 1 0.3355678E+00 2 0.1725020E+00 3 0.1082654E-01 4 0.3746570E-03 5 0.3553406E-05 6 0.1862914E-06 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1061170E-14 1 0.3183612E-01 2 0.1213833E+00 3 0.2979402E-01 4 0.1057900E-02 5 0.5975557E-05 6 0.3442789E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.3114461E-13 1 0.6451416E-03 2 0.1598367E-01 3 0.1121353E-01 4 0.7974567E-03 5 0.4494294E-05 6 0.5061121E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1148731E-06 1 0.2286696E-04 2 0.5393315E-03 3 0.8132790E-03 4 0.9450470E-04 5 0.8240303E-06 6 0.2252022E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.8676044E-16 1 0.2672995E-14 2 0.1385920E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.6881006E-19 1 0.3321502E-14 2 0.3322736E-16 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.4168476E-19 1 0.1232271E-13 2 0.2172061E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.1022171E-13 1 0.2760346E-13 2 0.5503989E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.6453922E-19 1 0.1009617E-13 2 0.3833836E-16 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2370576E-18 1 0.5802846E-14 2 0.1994494E-15 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.1894548E-13 1 0.1394902E-12 2 0.3981724E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.7442588E-19 1 0.2585674E-11 2 0.1782362E-12 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.6335474E-20 1 0.6506809E-10 2 0.1892802E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.5133365E-09 1 0.3186146E-09 2 0.7979743E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.8648324E-20 1 0.2775586E-10 2 0.2695748E-11 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.7884668E-19 1 0.5824616E-09 2 0.2148329E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.2952473E-08 1 0.1525398E-08 2 0.3541998E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.1019987E-18 1 0.5335740E-07 2 0.2687261E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.2126719E-18 1 0.1789173E-06 2 0.2921055E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1867114E-06 1 0.2452948E-06 2 0.5416578E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.5857942E-19 1 0.3627652E-06 2 0.3423923E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.3709359E-19 1 0.1339022E-06 2 0.1913063E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.7006865E-08 1 0.6419021E-08 2 0.4594168E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.4436919E-19 1 0.2441513E-08 2 0.2915801E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1799490E-18 1 0.2676266E-09 2 0.4786673E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1232068E-15 1 0.1113605E-07 2 0.3705525E-07 3 0.2746747E-07 4 0.3357519E-08 5 0.4139122E-08 6 0.2998017E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7528033E-15 1 0.1901652E-09 2 0.1767616E-09 3 0.7223716E-10 4 0.1980855E-09 5 0.2479141E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2426749E-08 1 0.2720169E-08 2 0.1174135E-08 3 0.6995194E-09 4 0.4617073E-08 5 0.1135790E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.4336260E-15 1 0.2879104E-08 2 0.1643044E-07 3 0.5860082E-08 4 0.6833138E-08 5 0.1423256E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1540006E-14 1 0.6230186E-06 2 0.2989599E-06 3 0.4564665E-07 4 0.4430634E-07 5 0.9932845E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.4047662E-08 1 0.2690836E-05 2 0.4241332E-06 3 0.5748461E-07 4 0.6875964E-07 5 0.2797097E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2470050E-12 1 0.1171715E-11 2 0.1313690E-11 3 0.1212129E-10 4 0.6290195E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2667072E-17 1 0.1272451E-10 2 0.4952904E-11 3 0.8956964E-10 4 0.1965471E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2268300E-16 1 0.1143290E-09 2 0.3208473E-10 3 0.4433916E-09 4 0.8218677E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.7665190E-09 1 0.1120693E-07 2 0.4189545E-08 3 0.1730811E-08 4 0.9357714E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.2368402E-16 1 0.4647162E-09 2 0.4883424E-08 3 0.8079057E-08 4 0.4930552E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.9814250E-16 1 0.7470180E-07 2 0.2309744E-07 3 0.6427663E-08 4 0.5054358E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.2603849E-08 1 0.3150939E-07 2 0.4495446E-07 3 0.4602333E-07 4 0.2711465E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.4168466E-16 1 0.1702319E-05 2 0.3105381E-06 3 0.4733028E-07 4 0.4255803E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2657765E-17 1 0.2909334E-05 2 0.1694848E-05 3 0.8894134E-07 4 0.3503749E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 1.0008599 average vibrational energy (ev) = 0.000006 average rotational energy (ev) = 0.494297 average diffraction energy (ev) = 0.018360 the reaction probability = -0.8599368D-03 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.40701096D+01 trans energy = 0.32142857D+00 trans energy in z = 0.32142857D+00 total momentum = 0.93167448D+01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9979365E+00 0.2618929E-01 0.4931318E+00 1 0.2166518E-03 0.2118087E-01 0.1371904E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1175086E-04 0 31 2 -2 0.6576323E-06 0 37 2 -1 0.6800975E-05 0 44 2 0 0.5357978E-05 0 50 2 1 0.4591239E-04 0 56 2 2 0.1692583E-04 0 21 4 -4 0.6462926E-07 0 26 4 -3 0.4161691E-06 0 32 4 -2 0.3150768E-05 0 38 4 -1 0.8769350E-05 0 45 4 0 0.3172963E-04 0 51 4 1 0.5828246E-04 0 57 4 2 0.1460443E-03 0 62 4 3 0.1847451E-03 0 67 4 4 0.4257889E-04 0 13 6 -6 0.1322408E-08 0 17 6 -5 0.3945056E-08 0 22 6 -4 0.1788749E-07 0 27 6 -3 0.7400469E-07 0 33 6 -2 0.3841193E-06 0 39 6 -1 0.6425566E-05 0 46 6 0 0.3547123E-04 0 52 6 1 0.2579555E-03 0 58 6 2 0.9647435E-03 0 63 6 3 0.2619419E-02 0 68 6 4 0.2698957E-02 0 72 6 5 0.1433079E-02 0 76 6 6 0.3839574E-03 0 7 8 -8 0.2023713E-10 0 10 8 -7 0.2094193E-10 0 14 8 -6 0.2057907E-10 0 18 8 -5 0.1120483E-09 0 23 8 -4 0.5474394E-09 0 28 8 -3 0.4586088E-08 0 34 8 -2 0.4003221E-07 0 40 8 -1 0.5200718E-06 0 47 8 0 0.8910838E-05 0 53 8 1 0.1842712E-03 0 59 8 2 0.3318246E-02 0 64 8 3 0.3208753E-01 0 69 8 4 0.2037021E+00 0 73 8 5 0.4075901E+00 0 77 8 6 0.2302014E+00 0 80 8 7 0.9239098E-01 0 83 8 8 0.1948270E-01 0 3 10 -10 0.1647405E-12 0 5 10 -9 0.3783259E-12 0 8 10 -8 0.8340002E-12 0 11 10 -7 0.2258084E-12 0 15 10 -6 0.8014434E-12 0 19 10 -5 0.4049854E-12 0 24 10 -4 0.1925129E-10 0 29 10 -3 0.1740514E-09 0 35 10 -2 0.4752706E-09 0 41 10 -1 0.2169367E-08 0 48 10 0 0.5908577E-08 0 54 10 1 0.2631616E-07 0 60 10 2 0.1941074E-06 0 65 10 3 0.4695225E-06 0 70 10 4 0.4806438E-06 0 74 10 5 0.1923434E-05 0 78 10 6 0.1105563E-05 0 81 10 7 0.9196028E-06 0 84 10 8 0.3087911E-06 0 86 10 9 0.4496535E-06 0 88 10 10 0.1056817E-06 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.2394396E-06 1 31 2 -2 0.1434986E-07 1 37 2 -1 0.4568612E-07 1 44 2 0 0.1730311E-06 1 50 2 1 0.2478999E-05 1 56 2 2 0.9220472E-05 1 21 4 -4 0.1580774E-09 1 26 4 -3 0.3297594E-09 1 32 4 -2 0.1480791E-08 1 38 4 -1 0.1401377E-07 1 45 4 0 0.2133800E-07 1 51 4 1 0.1695318E-06 1 57 4 2 0.1004774E-05 1 62 4 3 0.3972203E-04 1 67 4 4 0.1634602E-03 1 13 6 -6 0.3052413E-13 1 17 6 -5 0.2213755E-13 1 22 6 -4 0.7893617E-13 1 27 6 -3 0.3111049E-12 1 33 6 -2 0.1795358E-09 1 39 6 -1 0.6179846E-09 1 46 6 0 0.1917074E-09 1 52 6 1 0.6181797E-08 1 58 6 2 0.9835388E-09 1 63 6 3 0.1321000E-07 1 68 6 4 0.1910985E-07 1 72 6 5 0.3226906E-07 1 76 6 6 0.1322780E-07 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.2475627E-14 1 0.7939699E-07 2 0.2228808E-05 3 0.7079000E-05 4 0.1923865E-05 5 0.3409044E-06 6 0.6282872E-07 7 0.2066602E-07 8 0.1056173E-07 9 0.4832445E-08 v, j, mj = 0 2 -2 0 0.1221933E-13 1 0.1280872E-07 2 0.1301851E-07 3 0.2236473E-06 4 0.3460148E-06 5 0.3890587E-07 6 0.1413565E-07 7 0.3305702E-08 8 0.3229587E-08 9 0.2566141E-08 v, j, mj = 0 2 -1 0 0.2893027E-07 1 0.6252617E-07 2 0.4968074E-06 3 0.4217303E-05 4 0.1870977E-05 5 0.8891282E-07 6 0.1640390E-07 7 0.1083958E-07 8 0.5421774E-08 9 0.2853831E-08 v, j, mj = 0 2 0 0 0.4055396E-14 1 0.9229980E-07 2 0.6645637E-06 3 0.3393734E-05 4 0.1047309E-05 5 0.8464255E-07 6 0.3487099E-07 7 0.3367356E-07 8 0.4513411E-08 9 0.2371625E-08 v, j, mj = 0 2 1 0 0.4677342E-14 1 0.1239926E-05 2 0.2048682E-04 3 0.2202908E-04 4 0.1385618E-05 5 0.6222430E-06 6 0.9147120E-07 7 0.4321854E-07 8 0.9933444E-08 9 0.4072094E-08 v, j, mj = 0 2 2 0 0.1301558E-07 1 0.1765550E-05 2 0.1148451E-04 3 0.7296637E-06 4 0.1578554E-05 5 0.7983599E-06 6 0.3838088E-06 7 0.1495275E-06 8 0.2109113E-07 9 0.1747442E-08 v, j, mj = 0 4 -4 0 0.6027260E-09 1 0.2471074E-08 2 0.1973410E-07 3 0.1626034E-07 4 0.1489141E-07 5 0.5324688E-08 6 0.2271599E-08 7 0.9508177E-09 8 0.8234037E-09 9 0.1299100E-08 v, j, mj = 0 4 -3 0 0.1373682E-13 1 0.7291035E-07 2 0.1829020E-07 3 0.1229169E-06 4 0.1767737E-06 5 0.1509962E-07 6 0.2754205E-08 7 0.3696859E-08 8 0.2152814E-08 9 0.1574517E-08 v, j, mj = 0 4 -2 0 0.1253795E-14 1 0.2318478E-06 2 0.1690187E-06 3 0.1576099E-05 4 0.1056298E-05 5 0.8898980E-07 6 0.1781847E-07 7 0.5790979E-08 8 0.3063292E-08 9 0.1841801E-08 v, j, mj = 0 4 -1 0 0.2418208E-06 1 0.2138198E-07 2 0.5748635E-06 3 0.5213961E-05 4 0.2509766E-05 5 0.1414285E-06 6 0.5180064E-07 7 0.1162609E-07 8 0.1867208E-08 9 0.8344276E-09 v, j, mj = 0 4 0 0 0.2039710E-14 1 0.1093285E-06 2 0.1077771E-04 3 0.1837483E-04 4 0.2202703E-05 5 0.1272460E-06 6 0.1178429E-06 7 0.1287250E-07 8 0.5957795E-08 9 0.1132553E-08 v, j, mj = 0 4 1 0 0.7527850E-15 1 0.6782709E-06 2 0.2613762E-04 3 0.2972538E-04 4 0.1342304E-05 5 0.2972352E-06 6 0.6878388E-07 7 0.2689243E-07 8 0.3382925E-08 9 0.2588152E-08 v, j, mj = 0 4 2 0 0.3393477E-07 1 0.1959759E-04 2 0.1145604E-03 3 0.4842928E-05 4 0.5166738E-05 5 0.1709768E-05 6 0.7519167E-07 7 0.5109796E-07 8 0.5064420E-08 9 0.1614407E-08 v, j, mj = 0 4 3 0 0.4774511E-13 1 0.9643681E-04 2 0.6691784E-04 3 0.1351637E-04 4 0.4282406E-05 5 0.2934475E-05 6 0.5409290E-06 7 0.1082520E-06 8 0.4887609E-08 9 0.3126841E-08 v, j, mj = 0 4 4 0 0.4789491E-14 1 0.2424998E-04 2 0.8224749E-05 3 0.1248610E-05 4 0.3201292E-05 5 0.3403217E-05 6 0.1923918E-05 7 0.3173374E-06 8 0.6748374E-08 9 0.3039981E-08 v, j, mj = 0 6 -6 0 0.9710896E-14 1 0.3906758E-10 2 0.2167836E-09 3 0.2093718E-09 4 0.3105339E-09 5 0.1540398E-09 6 0.5137789E-10 7 0.8906301E-10 8 0.2177112E-09 9 0.3444934E-10 v, j, mj = 0 6 -5 0 0.2121381E-13 1 0.9391059E-10 2 0.1798894E-08 3 0.4690175E-09 4 0.5131677E-09 5 0.3354444E-09 6 0.1086099E-09 7 0.2096945E-09 8 0.3826393E-09 9 0.3365656E-10 v, j, mj = 0 6 -4 0 0.3464011E-10 1 0.5695463E-08 2 0.7432457E-08 3 0.1130114E-08 4 0.1730640E-08 5 0.4104238E-09 6 0.4828608E-09 7 0.5772086E-09 8 0.3563261E-09 9 0.3735794E-10 v, j, mj = 0 6 -3 0 0.1900295E-13 1 0.2536576E-07 2 0.5303992E-08 3 0.1661442E-07 4 0.1965935E-07 5 0.2646829E-08 6 0.2489160E-08 7 0.1284077E-08 8 0.6197269E-09 9 0.2135579E-10 v, j, mj = 0 6 -2 0 0.4761128E-14 1 0.1201505E-07 2 0.2758640E-07 3 0.1970608E-06 4 0.1300899E-06 5 0.1400589E-07 6 0.1215529E-08 7 0.1192543E-08 8 0.9381695E-09 9 0.1513873E-10 v, j, mj = 0 6 -1 0 0.2856609E-06 1 0.1071724E-06 2 0.1175110E-05 3 0.3731235E-05 4 0.9942088E-06 5 0.1170469E-06 6 0.9684598E-08 7 0.3716453E-08 8 0.1646557E-08 9 0.8516249E-10 v, j, mj = 0 6 0 0 0.1631155E-13 1 0.3409695E-06 2 0.8745805E-05 3 0.2219579E-04 4 0.4028052E-05 5 0.1434326E-06 6 0.9349493E-08 7 0.4712355E-08 8 0.2755630E-08 9 0.3569766E-09 v, j, mj = 0 6 1 0 0.5737198E-12 1 0.1842964E-04 2 0.1341453E-03 3 0.8584714E-04 4 0.1881990E-04 5 0.6649474E-06 6 0.3586659E-07 7 0.8061909E-08 8 0.4020659E-08 9 0.5590021E-09 v, j, mj = 0 6 2 0 0.1434313E-06 1 0.5779634E-04 2 0.5540597E-03 3 0.3018474E-03 4 0.4832133E-04 5 0.2408325E-05 6 0.1372287E-06 7 0.2036943E-07 8 0.8502455E-08 9 0.8187243E-09 v, j, mj = 0 6 3 0 0.6927241E-12 1 0.9783548E-03 2 0.7094046E-03 3 0.8486693E-03 4 0.8130833E-04 5 0.1557910E-05 6 0.9497088E-07 7 0.2040272E-07 8 0.8512913E-08 9 0.3718036E-09 v, j, mj = 0 6 4 0 0.1795444E-13 1 0.1689809E-02 2 0.4976303E-03 3 0.4561277E-03 4 0.4325722E-04 5 0.1122748E-04 6 0.8126886E-06 7 0.7145184E-07 8 0.2076312E-07 9 0.3985677E-09 v, j, mj = 0 6 5 0 0.1986396E-03 1 0.4419218E-03 2 0.6526058E-04 3 0.3122135E-03 4 0.3586122E-03 5 0.5451732E-04 6 0.1858562E-05 7 0.4409124E-07 8 0.1122709E-07 9 0.1143858E-09 v, j, mj = 0 6 6 0 0.2192183E-13 1 0.9256870E-04 2 0.2242209E-03 3 0.2192574E-04 4 0.2010514E-04 5 0.2135983E-04 6 0.3704904E-05 7 0.6217044E-07 8 0.9251915E-08 9 0.8086763E-09 v, j, mj = 0 8 -8 0 0.1385224E-13 1 0.3602152E-12 2 0.4843726E-12 3 0.1581742E-11 4 0.1054689E-11 5 0.3865422E-11 6 0.1195858E-10 7 0.9182546E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1230224E-12 1 0.8401144E-13 2 0.1024088E-11 3 0.4793407E-12 4 0.1645973E-11 5 0.7560025E-11 6 0.7110283E-11 7 0.2915191E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.6882396E-14 1 0.2726142E-12 2 0.1627329E-11 3 0.9722520E-12 4 0.1993312E-11 5 0.6834273E-11 6 0.7741130E-11 7 0.1131282E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.5618843E-14 1 0.2683640E-11 2 0.1165763E-10 3 0.6998127E-11 4 0.1130442E-10 5 0.1692531E-10 6 0.6000642E-10 7 0.2467117E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.4527763E-11 1 0.2939689E-10 2 0.1594358E-09 3 0.5798198E-10 4 0.9776952E-10 5 0.1240463E-09 6 0.7215043E-10 7 0.2130827E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.4511349E-14 1 0.1939745E-09 2 0.4722395E-09 3 0.1815893E-08 4 0.1180422E-08 5 0.2725772E-09 6 0.6311487E-09 7 0.1982812E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1659708E-14 1 0.3865867E-08 2 0.9059434E-08 3 0.1839106E-07 4 0.2928368E-08 5 0.4243029E-08 6 0.1511978E-08 7 0.3247210E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.9375736E-07 1 0.6018280E-07 2 0.7646962E-07 3 0.1756619E-06 4 0.9603284E-07 5 0.1031448E-07 6 0.7503426E-08 7 0.1493840E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1130233E-14 1 0.5610939E-06 2 0.3906131E-05 3 0.3637397E-05 4 0.6979263E-06 5 0.9039742E-07 6 0.1749419E-07 7 0.3987029E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.6626966E-13 1 0.8893601E-05 2 0.8643280E-04 3 0.8157933E-04 4 0.7064049E-05 5 0.2633492E-06 6 0.3619751E-07 7 0.1898926E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.7474570E-06 1 0.3475582E-03 2 0.1973921E-02 3 0.9305241E-03 4 0.6415881E-04 5 0.1273706E-05 6 0.6175797E-07 7 0.1636870E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.4506165E-12 1 0.3502374E-02 2 0.2216771E-01 3 0.6072779E-02 4 0.3406622E-03 5 0.3943191E-05 6 0.6700266E-07 7 0.1317939E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3878346E-14 1 0.7556597E-01 2 0.1112660E+00 3 0.1610109E-01 4 0.7574985E-03 5 0.1131876E-04 6 0.1341218E-06 7 0.4558098E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1096016E+00 1 0.1805240E+00 2 0.1061554E+00 3 0.9596091E-02 4 0.1671061E-02 5 0.4134306E-04 6 0.5769063E-06 7 0.3755978E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.8323994E-14 1 0.1409464E-01 2 0.1464037E+00 3 0.6494101E-01 4 0.4695856E-02 5 0.6601597E-04 6 0.1916581E-06 7 0.3723210E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.4953433E-12 1 0.1714599E-02 2 0.3141730E-01 3 0.5043001E-01 4 0.8645731E-02 5 0.1826546E-03 6 0.6781791E-06 7 0.7178983E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3183035E-07 1 0.2108218E-03 2 0.5214126E-02 3 0.1108668E-01 4 0.2884313E-02 5 0.8633981E-04 6 0.3812379E-06 7 0.8153712E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2403305E-15 1 0.1633902E-13 2 0.8135963E-13 3 0.6680148E-13 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.3955852E-18 1 0.1734974E-13 2 0.2050324E-12 3 0.1559433E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.4674485E-18 1 0.9471204E-13 2 0.5108716E-12 3 0.2284162E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.4320211E-14 1 0.3158612E-13 2 0.6124598E-13 3 0.1286561E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1215707E-18 1 0.3094759E-13 2 0.3079880E-12 3 0.4625077E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.4514641E-18 1 0.4934532E-13 2 0.1993166E-12 3 0.1563230E-12 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2245900E-13 1 0.4143880E-12 2 0.4494231E-11 3 0.1432021E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.3903732E-18 1 0.3293381E-11 2 0.6517261E-10 3 0.1055854E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.9314988E-19 1 0.3731101E-11 2 0.2873434E-09 3 0.1841961E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3520718E-09 1 0.2717494E-09 2 0.1439945E-08 3 0.1056011E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.4789844E-18 1 0.4114160E-09 2 0.2858909E-08 3 0.2638252E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.2604392E-18 1 0.4674516E-08 2 0.1152367E-07 3 0.1011798E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.4770973E-08 1 0.2817601E-08 2 0.3861590E-07 3 0.1479029E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.6397457E-17 1 0.1017385E-06 2 0.1345265E-06 3 0.2332574E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.6857113E-20 1 0.1508842E-06 2 0.1933238E-06 3 0.1364358E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.4686678E-06 1 0.8677140E-06 2 0.5021712E-06 3 0.8488144E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.5000599E-18 1 0.1510900E-06 2 0.7340051E-06 3 0.2204683E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.4113828E-17 1 0.3574136E-06 2 0.3283247E-06 3 0.2338644E-06 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.1267495E-07 1 0.9146757E-07 2 0.1455284E-06 3 0.5912023E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.3473307E-17 1 0.2562762E-06 2 0.1666652E-06 3 0.2671211E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.7472994E-18 1 0.1372118E-07 2 0.7069789E-07 3 0.2126266E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1043015E-14 1 0.4873912E-07 2 0.8229874E-07 3 0.7396357E-07 4 0.2537915E-07 5 0.5355856E-08 6 0.3647820E-08 7 0.5534916E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.4123520E-14 1 0.3361638E-08 2 0.5513639E-09 3 0.5540706E-09 4 0.6026761E-09 5 0.3232149E-08 6 0.6047955E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.1505961E-07 1 0.2056005E-09 2 0.1021105E-07 3 0.7843335E-08 4 0.3075568E-08 5 0.6494332E-08 6 0.2796625E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.4529698E-14 1 0.3293732E-07 2 0.9129034E-07 3 0.1114878E-07 4 0.2280812E-07 5 0.1038777E-07 6 0.4458714E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2813243E-14 1 0.7207974E-06 2 0.1248092E-05 3 0.3878514E-06 4 0.6854739E-07 5 0.4494587E-07 6 0.8764827E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1071359E-07 1 0.6020716E-05 2 0.1701352E-05 3 0.1347033E-05 4 0.1161964E-06 5 0.1359392E-07 6 0.1086676E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1397827E-11 1 0.2615649E-11 2 0.2223238E-11 3 0.1101347E-10 4 0.1090710E-09 5 0.3175618E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.5784569E-15 1 0.1719977E-10 2 0.5164998E-11 3 0.7242474E-10 4 0.1760018E-09 5 0.5896752E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.6186865E-15 1 0.4419353E-09 2 0.1333975E-09 3 0.3843250E-09 4 0.4839077E-09 5 0.3722501E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.5378160E-09 1 0.8112750E-08 2 0.2020539E-08 3 0.2307866E-08 4 0.9337392E-09 5 0.1010604E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7880035E-15 1 0.2802984E-08 2 0.5097884E-08 3 0.1174931E-07 4 0.1531446E-08 5 0.1563719E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.3253821E-14 1 0.2623666E-07 2 0.1205797E-06 3 0.1687420E-07 4 0.4351245E-08 5 0.1490028E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1394842E-07 1 0.2483130E-06 2 0.6510647E-06 3 0.8052987E-07 4 0.9094685E-08 5 0.1823666E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1363689E-13 1 0.2473894E-04 2 0.1357345E-04 3 0.1315264E-05 4 0.9358515E-07 5 0.7854394E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.5428309E-15 1 0.6461118E-04 2 0.8954135E-04 3 0.9198858E-05 4 0.1064762E-06 5 0.2301425E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2555484E-18 1 0.2385502E-13 2 0.6668855E-14 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.2679497E-18 1 0.5736464E-14 2 0.1640081E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.2474131E-14 1 0.6288458E-13 2 0.1357746E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.4693818E-19 1 0.2262684E-12 2 0.8483645E-13 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.1084223E-18 1 0.1648800E-09 2 0.1465583E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.1064371E-09 1 0.4991107E-09 2 0.1243683E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.1788414E-18 1 0.1594546E-09 2 0.3225286E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1787702E-18 1 0.5899710E-08 2 0.2820867E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.3527345E-09 1 0.5784444E-09 2 0.5235993E-10 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.1699325E-18 1 0.1285703E-07 2 0.3529629E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.2516633E-18 1 0.1794236E-07 2 0.1167485E-08 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.9073223E-09 1 0.3072812E-07 2 0.6336179E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.7858275E-18 1 0.1268194E-07 2 0.5458550E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9981531 average vibrational energy (ev) = 0.000111 average rotational energy (ev) = 0.493055 average diffraction energy (ev) = 0.026188 the reaction probability = 0.1846875D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.40129667D+01 trans energy = 0.37857143D+00 trans energy in z = 0.37857143D+00 total momentum = 0.10111041D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9965805E+00 0.3479073E-01 0.4908318E+00 1 0.1313062E-02 0.2998628E-01 0.1401556E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5189143E-04 0 31 2 -2 0.4269064E-05 0 37 2 -1 0.2997622E-04 0 44 2 0 0.2383756E-04 0 50 2 1 0.1927083E-03 0 56 2 2 0.6074245E-04 0 21 4 -4 0.1344349E-05 0 26 4 -3 0.3601503E-05 0 32 4 -2 0.2259897E-04 0 38 4 -1 0.4674905E-04 0 45 4 0 0.1104116E-03 0 51 4 1 0.1409939E-03 0 57 4 2 0.5555691E-03 0 62 4 3 0.5128228E-03 0 67 4 4 0.1473909E-03 0 13 6 -6 0.8371119E-07 0 17 6 -5 0.5554771E-07 0 22 6 -4 0.2251212E-06 0 27 6 -3 0.1119001E-05 0 33 6 -2 0.4964253E-05 0 39 6 -1 0.4916091E-04 0 46 6 0 0.2283524E-03 0 52 6 1 0.1058140E-02 0 58 6 2 0.2797537E-02 0 63 6 3 0.4304631E-02 0 68 6 4 0.5722151E-02 0 72 6 5 0.2359599E-02 0 76 6 6 0.8485113E-03 0 7 8 -8 0.1332643E-09 0 10 8 -7 0.1366094E-09 0 14 8 -6 0.9672796E-10 0 18 8 -5 0.5550777E-09 0 23 8 -4 0.2661575E-08 0 28 8 -3 0.1266864E-07 0 34 8 -2 0.2008637E-06 0 40 8 -1 0.2569122E-05 0 47 8 0 0.6525417E-04 0 53 8 1 0.9201171E-03 0 59 8 2 0.1122333E-01 0 64 8 3 0.6690987E-01 0 69 8 4 0.2092528E+00 0 73 8 5 0.2716516E+00 0 77 8 6 0.1867649E+00 0 80 8 7 0.1430582E+00 0 83 8 8 0.8741638E-01 0 3 10 -10 0.3013774E-11 0 5 10 -9 0.2099543E-11 0 8 10 -8 0.1524506E-11 0 11 10 -7 0.2952010E-11 0 15 10 -6 0.5852574E-11 0 19 10 -5 0.1054654E-10 0 24 10 -4 0.1255081E-09 0 29 10 -3 0.5548856E-09 0 35 10 -2 0.1377774E-08 0 41 10 -1 0.6530995E-08 0 48 10 0 0.1581426E-07 0 54 10 1 0.1194405E-06 0 60 10 2 0.1704155E-06 0 65 10 3 0.9859723E-06 0 70 10 4 0.1636541E-05 0 74 10 5 0.2460029E-04 0 78 10 6 0.5327433E-05 0 81 10 7 0.1679352E-05 0 84 10 8 0.7249660E-06 0 86 10 9 0.2147805E-06 0 88 10 10 0.4006261E-06 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.2674502E-05 1 31 2 -2 0.5043621E-07 1 37 2 -1 0.2648892E-06 1 44 2 0 0.1345681E-05 1 50 2 1 0.9914516E-05 1 56 2 2 0.2453727E-04 1 21 4 -4 0.5383392E-09 1 26 4 -3 0.1496510E-08 1 32 4 -2 0.4708515E-08 1 38 4 -1 0.4045274E-07 1 45 4 0 0.1999627E-06 1 51 4 1 0.2734770E-05 1 57 4 2 0.2736329E-04 1 62 4 3 0.3078394E-03 1 67 4 4 0.9325075E-03 1 13 6 -6 0.3319420E-11 1 17 6 -5 0.3989858E-11 1 22 6 -4 0.4332787E-11 1 27 6 -3 0.9669174E-10 1 33 6 -2 0.2375021E-08 1 39 6 -1 0.3964302E-08 1 46 6 0 0.2940422E-08 1 52 6 1 0.1139760E-07 1 58 6 2 0.2105569E-07 1 63 6 3 0.2325738E-06 1 68 6 4 0.3975730E-06 1 72 6 5 0.2713151E-05 1 76 6 6 0.1976490E-06 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.1537060E-13 1 0.1214545E-06 2 0.7668888E-05 3 0.2499602E-04 4 0.1083643E-04 5 0.6016758E-05 6 0.1790302E-05 7 0.4190475E-06 8 0.3757020E-07 9 0.4952241E-08 v, j, mj = 0 2 -2 0 0.1479945E-12 1 0.1287420E-06 2 0.2358365E-06 3 0.9604764E-06 4 0.1400275E-05 5 0.1166165E-05 6 0.3070202E-06 7 0.6329689E-07 8 0.5227663E-08 9 0.2024522E-08 v, j, mj = 0 2 -1 0 0.7319796E-07 1 0.2718240E-06 2 0.1723569E-05 3 0.1666089E-04 4 0.8937547E-05 5 0.2011482E-05 6 0.2524423E-06 7 0.3494853E-07 8 0.8079547E-08 9 0.2232027E-08 v, j, mj = 0 2 0 0 0.3713525E-13 1 0.1951862E-06 2 0.1226639E-05 3 0.1304770E-04 4 0.8107387E-05 5 0.7493904E-06 6 0.3276981E-06 7 0.1701674E-06 8 0.8940376E-08 9 0.4451146E-08 v, j, mj = 0 2 1 0 0.1606022E-12 1 0.3138815E-05 2 0.7434157E-04 3 0.9120251E-04 4 0.1511063E-04 5 0.6642647E-05 6 0.1742543E-05 7 0.4868115E-06 8 0.3771137E-07 9 0.5109229E-08 v, j, mj = 0 2 2 0 0.3382451E-07 1 0.5465349E-05 2 0.2773126E-04 3 0.3903009E-05 4 0.7111708E-05 5 0.7381250E-05 6 0.6024169E-05 7 0.2633934E-05 8 0.4448984E-06 9 0.1305221E-07 v, j, mj = 0 4 -4 0 0.2630386E-08 1 0.2646060E-07 2 0.8131903E-07 3 0.3243352E-06 4 0.5296298E-06 5 0.2843454E-06 6 0.8151424E-07 7 0.1137021E-07 8 0.1369754E-08 9 0.1374789E-08 v, j, mj = 0 4 -3 0 0.1699942E-14 1 0.2658053E-06 2 0.1664598E-06 3 0.1115471E-05 4 0.1787142E-05 5 0.2415725E-06 6 0.1604360E-07 7 0.4784728E-08 8 0.2625982E-08 9 0.1597895E-08 v, j, mj = 0 4 -2 0 0.1037633E-13 1 0.9670977E-06 2 0.1158757E-05 3 0.1175130E-04 4 0.8343788E-05 5 0.3157184E-06 6 0.4418251E-07 7 0.1249321E-07 8 0.3522447E-08 9 0.2108011E-08 v, j, mj = 0 4 -1 0 0.7811241E-06 1 0.3291510E-06 2 0.2814172E-05 3 0.3117282E-04 4 0.1151735E-04 5 0.5622544E-07 6 0.6336944E-07 7 0.1198707E-07 8 0.1897867E-08 9 0.9611308E-09 v, j, mj = 0 4 0 0 0.2015819E-14 1 0.1734162E-06 2 0.4158361E-04 3 0.6552341E-04 4 0.2656229E-05 5 0.2864742E-06 6 0.1494191E-06 7 0.3395734E-07 8 0.2518312E-08 9 0.2529235E-08 v, j, mj = 0 4 1 0 0.1327872E-12 1 0.1517317E-05 2 0.6968301E-04 3 0.6584654E-04 4 0.2607102E-05 5 0.9939397E-06 6 0.2622010E-06 7 0.7492984E-07 8 0.6305602E-08 9 0.2510395E-08 v, j, mj = 0 4 2 0 0.7422789E-07 1 0.5597265E-04 2 0.3762319E-03 3 0.8427638E-04 4 0.2530782E-04 5 0.1122027E-04 6 0.2247251E-05 7 0.2227105E-06 8 0.1386414E-07 9 0.1958986E-08 v, j, mj = 0 4 3 0 0.3278834E-12 1 0.2333201E-03 2 0.1687899E-03 3 0.6257198E-04 4 0.2010018E-04 5 0.2074711E-04 6 0.6389429E-05 7 0.8887763E-06 8 0.9628127E-08 9 0.5786021E-08 v, j, mj = 0 4 4 0 0.3033715E-13 1 0.2755771E-04 2 0.5328956E-04 3 0.8404802E-05 4 0.5314903E-05 5 0.2282712E-04 6 0.2349139E-04 7 0.6184942E-05 8 0.3164602E-06 9 0.4035818E-08 v, j, mj = 0 6 -6 0 0.5014302E-13 1 0.7333780E-09 2 0.1168872E-07 3 0.2365484E-07 4 0.2697417E-07 5 0.1687860E-07 6 0.3198996E-08 7 0.1998464E-09 8 0.1862849E-09 9 0.1963096E-09 v, j, mj = 0 6 -5 0 0.6577708E-13 1 0.1450747E-08 2 0.2581885E-07 3 0.1255995E-07 4 0.9630339E-08 5 0.4684171E-08 6 0.4639522E-09 7 0.2531936E-09 8 0.4475537E-09 9 0.2388939E-09 v, j, mj = 0 6 -4 0 0.2632199E-09 1 0.4197864E-07 2 0.8613749E-07 3 0.3868688E-07 4 0.5069030E-07 5 0.4552736E-08 6 0.1485818E-08 7 0.7555839E-09 8 0.4172991E-09 9 0.1532471E-09 v, j, mj = 0 6 -3 0 0.6200191E-13 1 0.2524798E-06 2 0.7786467E-07 3 0.3647708E-06 4 0.4045883E-06 5 0.1404599E-07 6 0.2455002E-08 7 0.1299283E-08 8 0.1265356E-08 9 0.2315703E-09 v, j, mj = 0 6 -2 0 0.9699776E-14 1 0.1198860E-06 2 0.3297068E-06 3 0.2872767E-05 4 0.1576504E-05 5 0.6054044E-07 6 0.2014130E-08 7 0.1787696E-08 8 0.8042243E-09 9 0.2424116E-09 v, j, mj = 0 6 -1 0 0.1402393E-05 1 0.7811967E-06 2 0.9344271E-05 3 0.3152298E-04 4 0.5853071E-05 5 0.2398909E-06 6 0.7066754E-08 7 0.6194883E-08 8 0.3435585E-08 9 0.4167256E-09 v, j, mj = 0 6 0 0 0.1170842E-12 1 0.1961978E-05 2 0.6862999E-04 3 0.1422323E-03 4 0.1508058E-04 5 0.4211353E-06 6 0.1749548E-07 7 0.5157375E-08 8 0.2112537E-08 9 0.1692180E-08 v, j, mj = 0 6 1 0 0.2962947E-11 1 0.6262717E-04 2 0.6276989E-03 3 0.3118726E-03 4 0.5382898E-04 5 0.2031753E-05 6 0.6738391E-07 7 0.8776271E-08 8 0.3692203E-08 9 0.7504494E-09 v, j, mj = 0 6 2 0 0.5234832E-06 1 0.2413073E-03 2 0.1698537E-02 3 0.7298407E-03 4 0.1222850E-03 5 0.4799362E-05 6 0.1869284E-06 7 0.4987890E-07 8 0.4179143E-08 9 0.2422006E-08 v, j, mj = 0 6 3 0 0.1893356E-11 1 0.1859992E-02 2 0.7406102E-03 3 0.1587177E-02 4 0.1108018E-03 5 0.4957269E-05 6 0.1031547E-05 7 0.4963406E-07 8 0.9047884E-08 9 0.2113136E-08 v, j, mj = 0 6 4 0 0.5533625E-13 1 0.4394609E-02 2 0.7961593E-03 3 0.3376985E-03 4 0.1184630E-03 5 0.6677936E-04 6 0.8039170E-05 7 0.3885057E-06 8 0.1109986E-07 9 0.2776162E-08 v, j, mj = 0 6 5 0 0.3803797E-03 1 0.5092312E-03 2 0.2336809E-03 3 0.3655646E-03 4 0.6876725E-03 5 0.1709100E-03 6 0.1182377E-04 7 0.3096526E-06 8 0.2177718E-07 9 0.5270755E-08 v, j, mj = 0 6 6 0 0.1075292E-12 1 0.6038730E-04 2 0.2487798E-03 3 0.2286850E-04 4 0.1930474E-03 5 0.2509341E-03 6 0.6980992E-04 7 0.2658260E-05 8 0.2220531E-07 9 0.3895889E-08 v, j, mj = 0 8 -8 0 0.8052482E-13 1 0.4807522E-11 2 0.2505142E-10 3 0.4403995E-10 4 0.2911577E-10 5 0.7173001E-11 6 0.1121724E-10 7 0.1177887E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.2935416E-12 1 0.3089926E-11 2 0.3030043E-10 3 0.5036083E-10 4 0.2450583E-10 5 0.7368300E-11 6 0.6973284E-11 7 0.1371726E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1143800E-13 1 0.6204780E-11 2 0.1287731E-10 3 0.1811263E-10 4 0.7875460E-11 5 0.1130733E-10 6 0.1707782E-10 7 0.2326119E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.4998361E-13 1 0.2569906E-10 2 0.2006357E-09 3 0.8109016E-10 4 0.8039245E-10 5 0.2844192E-10 6 0.8309978E-10 7 0.5566858E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1807099E-10 1 0.2767394E-09 2 0.1169650E-08 3 0.1633973E-09 4 0.4371975E-09 5 0.3196302E-09 6 0.2192889E-09 7 0.5760092E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1858023E-13 1 0.1788380E-08 2 0.4294484E-08 3 0.3403996E-08 4 0.1944240E-08 5 0.5846354E-09 6 0.5786362E-09 7 0.7424659E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.5887810E-14 1 0.6037726E-07 2 0.3616920E-07 3 0.7369237E-07 4 0.2260004E-07 5 0.3594319E-08 6 0.3307915E-08 7 0.1122593E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2897373E-06 1 0.2140048E-06 2 0.2049819E-06 3 0.1370609E-05 4 0.4607932E-06 5 0.2115721E-07 6 0.6437667E-08 7 0.1400922E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1960358E-13 1 0.1151989E-05 2 0.2743664E-04 3 0.3158546E-04 4 0.4850453E-05 5 0.2010491E-06 6 0.2078612E-07 7 0.7789999E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.9679180E-12 1 0.9712197E-05 2 0.4593913E-03 3 0.4130526E-03 4 0.3674167E-04 5 0.1193448E-05 6 0.1900000E-07 7 0.6935275E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1330539E-05 1 0.1345567E-02 2 0.6760165E-02 3 0.2911995E-02 4 0.1992326E-03 5 0.4963225E-05 6 0.7008532E-07 7 0.8620885E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.4508865E-11 1 0.1061609E-01 2 0.4521708E-01 3 0.1043143E-01 4 0.6259522E-03 5 0.1906993E-04 6 0.2457078E-06 7 0.9593869E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2358792E-13 1 0.7680215E-01 2 0.1181705E+00 3 0.1262339E-01 4 0.1574467E-02 5 0.8134953E-04 6 0.9209483E-06 7 0.1527566E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1246252E+00 1 0.9043143E-01 2 0.3279218E-01 3 0.1815861E-01 4 0.5402462E-02 5 0.2390969E-03 6 0.2640545E-05 7 0.1301339E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1892801E-13 1 0.3829750E-02 2 0.1229573E+00 3 0.5188836E-01 4 0.7702538E-02 5 0.3823330E-03 6 0.4578284E-05 7 0.2186488E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.2733108E-11 1 0.1503975E-02 2 0.3241138E-01 3 0.7757625E-01 4 0.2981931E-01 5 0.1734207E-02 6 0.1301708E-04 7 0.2304124E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.5370981E-07 1 0.2265335E-03 2 0.1251884E-01 3 0.4675529E-01 4 0.2583341E-01 5 0.2061414E-02 6 0.2081568E-04 7 0.2062420E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2972582E-14 1 0.5588232E-14 2 0.1027841E-11 3 0.1006204E-11 4 0.9711683E-12 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.3728797E-16 1 0.4548032E-13 2 0.4728438E-12 3 0.4542045E-12 4 0.1126977E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.2350370E-16 1 0.1187753E-12 2 0.1817383E-12 3 0.3168349E-12 4 0.9071338E-12 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.2164114E-12 1 0.7216558E-13 2 0.5281881E-12 3 0.1114037E-11 4 0.1021208E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1527123E-16 1 0.1270680E-12 2 0.1854942E-11 3 0.8382275E-12 4 0.3032321E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.8843838E-17 1 0.7788757E-12 2 0.2228861E-11 3 0.2885969E-11 4 0.4652828E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2100778E-12 1 0.2863518E-10 2 0.1536104E-10 3 0.2905294E-10 4 0.5224888E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.9054227E-18 1 0.2226143E-10 2 0.2046241E-09 3 0.1699703E-09 4 0.1580298E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.2753362E-17 1 0.1217877E-09 2 0.5152682E-09 3 0.3279800E-09 4 0.4127384E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.7363872E-09 1 0.1364100E-08 2 0.1230738E-08 3 0.1147573E-08 4 0.2052197E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.2289592E-17 1 0.3194094E-09 2 0.1819622E-08 3 0.8113690E-08 4 0.5561536E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.5337605E-16 1 0.5412979E-08 2 0.2007638E-07 3 0.4438772E-07 4 0.4956346E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1064977E-08 1 0.2587697E-08 2 0.5172299E-07 3 0.8723885E-07 4 0.2780098E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.3602104E-15 1 0.5710583E-07 2 0.4253038E-06 3 0.3738931E-06 4 0.1296696E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.2858982E-17 1 0.6190338E-06 2 0.6338880E-06 3 0.3264952E-06 4 0.5712412E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.1058657E-04 1 0.1094764E-04 2 0.2436185E-05 3 0.5681608E-06 4 0.6173332E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.5559037E-16 1 0.4286134E-05 2 0.5464831E-06 3 0.4548425E-06 4 0.3997394E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.4628169E-15 1 0.1775250E-06 2 0.6114627E-06 3 0.6953141E-06 4 0.1950504E-06 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.4837186E-07 1 0.1779377E-06 2 0.2801014E-06 3 0.1871173E-06 4 0.3143781E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.5993842E-15 1 0.3293305E-07 2 0.8625638E-07 3 0.7580845E-07 4 0.1978259E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.7776241E-16 1 0.3363986E-07 2 0.1293287E-06 3 0.2015186E-06 4 0.3613894E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.5604516E-15 1 0.3065959E-06 2 0.7330351E-06 3 0.1351627E-05 4 0.2371630E-06 5 0.3595286E-07 6 0.6190918E-08 7 0.3937679E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1380453E-13 1 0.1024114E-07 2 0.2087167E-07 3 0.1039793E-07 4 0.2249274E-08 5 0.1795210E-08 6 0.4790474E-08 7 0.9049684E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.8232060E-07 1 0.3381428E-08 2 0.2048703E-07 3 0.1234073E-06 4 0.2629955E-07 5 0.3120387E-08 6 0.5734987E-08 7 0.1378804E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.2430626E-13 1 0.5334212E-07 2 0.8211776E-06 3 0.3767045E-06 4 0.7782104E-07 5 0.1219650E-07 6 0.4097436E-08 7 0.3421604E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2668448E-13 1 0.6192769E-06 2 0.4376188E-05 3 0.3981680E-05 4 0.8622240E-06 5 0.6065622E-07 6 0.1415147E-07 7 0.3395250E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2915542E-07 1 0.1115606E-04 2 0.4241668E-05 3 0.4504850E-05 4 0.4369902E-05 5 0.2245014E-06 6 0.9883471E-08 7 0.1244175E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.4494748E-11 1 0.1553668E-10 2 0.1241982E-09 3 0.7114654E-10 4 0.6465988E-10 5 0.2500790E-09 6 0.8224062E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1093309E-14 1 0.8037802E-10 2 0.4024205E-09 3 0.1306647E-09 4 0.3522821E-09 5 0.5267134E-09 6 0.4050153E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.7889974E-14 1 0.5697722E-09 2 0.8152697E-09 3 0.7342350E-09 4 0.1593391E-08 5 0.9915490E-09 6 0.4290563E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.4213526E-08 1 0.1210609E-07 2 0.9915283E-08 3 0.8435467E-08 4 0.3494567E-08 5 0.2286981E-08 6 0.8182616E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.1137310E-13 1 0.6231260E-08 2 0.8538114E-07 3 0.9377347E-07 4 0.1292728E-07 5 0.1620133E-08 6 0.2940209E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1222151E-12 1 0.3113395E-06 2 0.1554135E-05 3 0.8153677E-06 4 0.5121460E-07 5 0.2672343E-08 6 0.4096019E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.9772212E-08 1 0.4510485E-05 2 0.1871733E-04 3 0.3767180E-05 4 0.3033036E-06 5 0.5515499E-07 6 0.6416787E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.7515402E-13 1 0.1146306E-03 2 0.1488980E-03 3 0.4183695E-04 4 0.2452192E-05 5 0.2158837E-07 6 0.6643802E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.2020262E-14 1 0.2506008E-03 2 0.4707178E-03 3 0.2011174E-03 4 0.9951563E-05 5 0.1198544E-06 6 0.1938749E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2718892E-17 1 0.1483829E-12 2 0.4941015E-12 3 0.2676933E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.1068273E-17 1 0.2045939E-12 2 0.8031126E-12 3 0.2982150E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1525179E-12 1 0.4823342E-12 2 0.1953085E-11 3 0.1744850E-11 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.1618368E-17 1 0.1404268E-11 2 0.3057489E-10 3 0.6471258E-10 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.9122047E-17 1 0.5812563E-09 2 0.1393937E-08 3 0.3998275E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.3263390E-09 1 0.2223558E-08 2 0.1312466E-08 3 0.1019396E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.1495544E-16 1 0.8597325E-09 2 0.1433332E-08 3 0.6473577E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1880253E-15 1 0.3116470E-08 2 0.8022094E-08 3 0.2590340E-09 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.4102603E-08 1 0.7059759E-08 2 0.6681259E-08 3 0.3212073E-08 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.1618120E-15 1 0.9382985E-07 2 0.1235021E-06 3 0.1524178E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.4337839E-17 1 0.3216802E-06 2 0.5773351E-07 3 0.1815932E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.5878234E-06 1 0.1739471E-05 2 0.3718512E-06 3 0.1400467E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.3419715E-17 1 0.1423647E-06 2 0.3883182E-07 3 0.1645241E-07 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9978936 average vibrational energy (ev) = 0.000670 average rotational energy (ev) = 0.490370 average diffraction energy (ev) = 0.034784 the reaction probability = 0.2106391D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.39558238D+01 trans energy = 0.43571429D+00 trans energy in z = 0.43571429D+00 total momentum = 0.10847330D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9952357E+00 0.4364711E-01 0.4865178E+00 1 0.2972299E-02 0.2527614E-01 0.1790215E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1714694E-03 0 31 2 -2 0.2798978E-04 0 37 2 -1 0.1183446E-03 0 44 2 0 0.1223384E-03 0 50 2 1 0.5687578E-03 0 56 2 2 0.2513827E-03 0 21 4 -4 0.1224158E-04 0 26 4 -3 0.2571249E-04 0 32 4 -2 0.1110237E-03 0 38 4 -1 0.1733723E-03 0 45 4 0 0.2859970E-03 0 51 4 1 0.3019981E-03 0 57 4 2 0.1618656E-02 0 62 4 3 0.9327651E-03 0 67 4 4 0.6457755E-03 0 13 6 -6 0.1394423E-05 0 17 6 -5 0.8270484E-06 0 22 6 -4 0.2691890E-05 0 27 6 -3 0.1212243E-04 0 33 6 -2 0.4096698E-04 0 39 6 -1 0.2598353E-03 0 46 6 0 0.9739283E-03 0 52 6 1 0.3031053E-02 0 58 6 2 0.5091761E-02 0 63 6 3 0.6574346E-02 0 68 6 4 0.9811704E-02 0 72 6 5 0.3988939E-02 0 76 6 6 0.2748686E-02 0 7 8 -8 0.5529192E-08 0 10 8 -7 0.3586348E-08 0 14 8 -6 0.9155728E-09 0 18 8 -5 0.7583383E-08 0 23 8 -4 0.2660365E-07 0 28 8 -3 0.1127743E-06 0 34 8 -2 0.1848493E-05 0 40 8 -1 0.2167928E-04 0 47 8 0 0.3872543E-03 0 53 8 1 0.3803848E-02 0 59 8 2 0.2841783E-01 0 64 8 3 0.1013319E+00 0 69 8 4 0.1475261E+00 0 73 8 5 0.2376464E+00 0 77 8 6 0.1179651E+00 0 80 8 7 0.1286545E+00 0 83 8 8 0.1912909E+00 0 3 10 -10 0.1723915E-10 0 5 10 -9 0.5814766E-11 0 8 10 -8 0.8535078E-11 0 11 10 -7 0.1394846E-10 0 15 10 -6 0.3585682E-10 0 19 10 -5 0.1090983E-09 0 24 10 -4 0.6174275E-09 0 29 10 -3 0.3407891E-08 0 35 10 -2 0.7775628E-08 0 41 10 -1 0.1849901E-07 0 48 10 0 0.5908586E-07 0 54 10 1 0.4156781E-06 0 60 10 2 0.2228142E-05 0 65 10 3 0.4757245E-05 0 70 10 4 0.2582629E-04 0 74 10 5 0.1949158E-03 0 78 10 6 0.4679715E-04 0 81 10 7 0.3943269E-05 0 84 10 8 0.7916951E-06 0 86 10 9 0.1173751E-05 0 88 10 10 0.1198480E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.7286981E-05 1 31 2 -2 0.7779924E-06 1 37 2 -1 0.1976864E-05 1 44 2 0 0.8550544E-05 1 50 2 1 0.3944378E-04 1 56 2 2 0.4463792E-04 1 21 4 -4 0.9276784E-08 1 26 4 -3 0.1224353E-07 1 32 4 -2 0.3146300E-07 1 38 4 -1 0.5550875E-06 1 45 4 0 0.5317115E-05 1 51 4 1 0.4587408E-04 1 57 4 2 0.3114540E-03 1 62 4 3 0.1234790E-02 1 67 4 4 0.4945557E-03 1 13 6 -6 0.1901010E-10 1 17 6 -5 0.2756969E-10 1 22 6 -4 0.8754266E-10 1 27 6 -3 0.2311857E-09 1 33 6 -2 0.1155285E-08 1 39 6 -1 0.8104512E-08 1 46 6 0 0.6611904E-08 1 52 6 1 0.9618904E-07 1 58 6 2 0.8295656E-06 1 63 6 3 0.8523853E-05 1 68 6 4 0.7655902E-04 1 72 6 5 0.4648764E-03 1 76 6 6 0.2261249E-03 1 7 8 -8 0.0000000E+00 1 10 8 -7 0.0000000E+00 1 14 8 -6 0.0000000E+00 1 18 8 -5 0.0000000E+00 1 23 8 -4 0.0000000E+00 1 28 8 -3 0.0000000E+00 1 34 8 -2 0.0000000E+00 1 40 8 -1 0.0000000E+00 1 47 8 0 0.0000000E+00 1 53 8 1 0.0000000E+00 1 59 8 2 0.0000000E+00 1 64 8 3 0.0000000E+00 1 69 8 4 0.0000000E+00 1 73 8 5 0.0000000E+00 1 77 8 6 0.0000000E+00 1 80 8 7 0.0000000E+00 1 83 8 8 0.0000000E+00 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.3090073E-12 1 0.1505838E-06 2 0.9635619E-05 3 0.5961020E-04 4 0.4667276E-04 5 0.2794842E-04 6 0.1897033E-04 7 0.7169721E-05 8 0.1238400E-05 9 0.7336790E-07 v, j, mj = 0 2 -2 0 0.3097103E-11 1 0.8951853E-06 2 0.1576017E-05 3 0.5181140E-05 4 0.4833849E-05 5 0.7287905E-05 6 0.5905160E-05 7 0.2030363E-05 8 0.2681629E-06 9 0.1198916E-07 v, j, mj = 0 2 -1 0 0.8760280E-07 1 0.3604421E-06 2 0.3855086E-05 3 0.4628341E-04 4 0.4746783E-04 5 0.1582458E-04 6 0.3658561E-05 7 0.7163603E-06 8 0.8757477E-07 9 0.3174165E-08 v, j, mj = 0 2 0 0 0.2645126E-11 1 0.4364574E-07 2 0.7258586E-05 3 0.3973382E-04 4 0.4759847E-04 5 0.1951811E-04 6 0.5433474E-05 7 0.2236551E-05 8 0.4893242E-06 9 0.2646067E-07 v, j, mj = 0 2 1 0 0.5301028E-14 1 0.2858114E-05 2 0.1362340E-03 3 0.2374957E-03 4 0.1228256E-03 5 0.4151601E-04 6 0.2038340E-04 7 0.6622174E-05 8 0.7950714E-06 9 0.2769751E-07 v, j, mj = 0 2 2 0 0.1828906E-07 1 0.7897777E-05 2 0.6985240E-04 3 0.5838755E-04 4 0.6269867E-05 5 0.2701179E-04 6 0.4479756E-04 7 0.2902455E-04 8 0.7698898E-05 9 0.4239883E-06 v, j, mj = 0 4 -4 0 0.6573329E-08 1 0.1967588E-06 2 0.2334161E-06 3 0.1061814E-05 4 0.3668288E-05 5 0.4298362E-05 6 0.2245117E-05 7 0.4968099E-06 8 0.3293957E-07 9 0.1503694E-08 v, j, mj = 0 4 -3 0 0.4386556E-12 1 0.3810340E-06 2 0.2560357E-05 3 0.7090876E-05 4 0.1216811E-04 5 0.2888120E-05 6 0.5413490E-06 7 0.7717696E-07 8 0.4189193E-08 9 0.1280931E-08 v, j, mj = 0 4 -2 0 0.1326665E-12 1 0.2502358E-05 2 0.5682826E-05 3 0.4971502E-04 4 0.4589613E-04 5 0.6343713E-05 6 0.7570889E-06 7 0.1130170E-06 8 0.1083411E-07 9 0.2758197E-08 v, j, mj = 0 4 -1 0 0.9215923E-06 1 0.2959991E-05 2 0.5795022E-05 3 0.1136827E-03 4 0.4670363E-04 5 0.2902476E-05 6 0.2922277E-06 7 0.1006134E-06 8 0.1308930E-07 9 0.9980539E-09 v, j, mj = 0 4 0 0 0.3825132E-12 1 0.7296839E-06 2 0.8840664E-04 3 0.1813778E-03 4 0.1135250E-04 5 0.2681751E-05 6 0.1171779E-05 7 0.2487527E-06 8 0.2418567E-07 9 0.3916424E-08 v, j, mj = 0 4 1 0 0.9746070E-12 1 0.2233801E-05 2 0.1275150E-03 3 0.1269811E-03 4 0.3007519E-04 5 0.9032396E-05 6 0.4874722E-05 7 0.1179494E-05 8 0.1033704E-06 9 0.2990538E-08 v, j, mj = 0 4 2 0 0.2282523E-06 1 0.9888044E-04 2 0.7416674E-03 3 0.4975568E-03 4 0.1629468E-03 5 0.8224221E-04 6 0.2865336E-04 7 0.6023984E-05 8 0.4506964E-06 9 0.6117982E-08 v, j, mj = 0 4 3 0 0.7356169E-12 1 0.3242714E-03 2 0.1913216E-03 3 0.1895087E-03 4 0.8404226E-04 5 0.7375013E-04 6 0.5558769E-04 7 0.1364918E-04 8 0.6296943E-06 9 0.4524259E-08 v, j, mj = 0 4 4 0 0.2904637E-12 1 0.1578321E-03 2 0.1481656E-03 3 0.9348334E-05 4 0.1154436E-04 5 0.9261697E-04 6 0.1507573E-03 7 0.6858492E-04 8 0.6855334E-05 9 0.7054886E-07 v, j, mj = 0 6 -6 0 0.1374213E-12 1 0.2490430E-07 2 0.6898825E-07 3 0.2217654E-06 4 0.4509658E-06 5 0.4421248E-06 6 0.1709981E-06 7 0.1396718E-07 8 0.3783612E-09 9 0.3305203E-09 v, j, mj = 0 6 -5 0 0.2163988E-12 1 0.1162015E-06 2 0.2765791E-06 3 0.7170378E-07 4 0.1972764E-06 5 0.1277269E-06 6 0.3390592E-07 7 0.3041646E-08 8 0.2703048E-09 9 0.3426680E-09 v, j, mj = 0 6 -4 0 0.6387023E-08 1 0.4101771E-06 2 0.6933917E-06 3 0.6774007E-06 4 0.7763029E-06 5 0.1190441E-06 6 0.7459621E-08 7 0.1003043E-08 8 0.5142988E-09 9 0.2096836E-09 v, j, mj = 0 6 -3 0 0.4984412E-12 1 0.1562437E-05 2 0.1453144E-05 3 0.4616386E-05 4 0.4294564E-05 5 0.1855897E-06 6 0.5502587E-08 7 0.2455510E-08 8 0.1690413E-08 9 0.6633144E-09 v, j, mj = 0 6 -2 0 0.2189186E-14 1 0.1297128E-05 2 0.2985238E-05 3 0.2510034E-04 4 0.1141637E-04 5 0.1562652E-06 6 0.7262972E-08 7 0.2891162E-08 8 0.1281854E-08 9 0.2066226E-09 v, j, mj = 0 6 -1 0 0.7786979E-05 1 0.4034939E-05 2 0.4709490E-04 3 0.1763991E-03 4 0.2430708E-04 5 0.1891199E-06 6 0.9718877E-08 7 0.9161286E-08 8 0.3160318E-08 9 0.1213488E-08 v, j, mj = 0 6 0 0 0.5413777E-12 1 0.9754281E-05 2 0.3332234E-03 3 0.5885244E-03 4 0.4130304E-04 5 0.1053986E-05 6 0.6026705E-07 7 0.5236352E-08 8 0.2330289E-08 9 0.1421507E-08 v, j, mj = 0 6 1 0 0.8531894E-11 1 0.1625028E-03 2 0.1950594E-02 3 0.7959974E-03 4 0.1174384E-03 5 0.4100901E-05 6 0.3542056E-06 7 0.5910253E-07 8 0.4396396E-08 9 0.2260804E-08 v, j, mj = 0 6 2 0 0.1416012E-05 1 0.6078738E-03 2 0.3096562E-02 3 0.1151564E-02 4 0.2100852E-03 5 0.2107568E-04 6 0.2952056E-05 7 0.2250396E-06 8 0.5896633E-08 9 0.1927164E-08 v, j, mj = 0 6 3 0 0.1291623E-11 1 0.2469278E-02 2 0.1014047E-02 3 0.2745363E-02 4 0.2348218E-03 5 0.9402778E-04 6 0.1556013E-04 7 0.1220589E-05 8 0.2491298E-07 9 0.2658317E-08 v, j, mj = 0 6 4 0 0.1673270E-12 1 0.6802749E-02 2 0.1460233E-02 3 0.3688986E-03 4 0.7725938E-03 5 0.3421021E-03 6 0.6107303E-04 7 0.3993227E-05 8 0.5566531E-07 9 0.6190626E-08 v, j, mj = 0 6 5 0 0.3917135E-03 1 0.8719521E-03 2 0.8877660E-03 3 0.5634265E-03 4 0.7288372E-03 5 0.4418012E-03 6 0.9661877E-04 7 0.6702387E-05 8 0.1090095E-06 9 0.1277154E-07 v, j, mj = 0 6 6 0 0.5135178E-12 1 0.1357587E-03 2 0.7939681E-04 3 0.2558309E-03 4 0.6775612E-03 5 0.1079120E-02 6 0.4780903E-03 7 0.4249980E-04 8 0.4240735E-06 9 0.4878570E-08 v, j, mj = 0 8 -8 0 0.1866373E-12 1 0.4649778E-10 2 0.4118819E-09 3 0.1734283E-08 4 0.2579909E-08 5 0.6801499E-09 6 0.2750978E-10 7 0.2617755E-10 8 0.2259565E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1062534E-09 1 0.1707330E-09 2 0.3696195E-09 3 0.9784542E-09 4 0.1557868E-08 5 0.3208510E-09 6 0.3019032E-10 7 0.2522262E-10 8 0.2715655E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2337093E-12 1 0.4370501E-10 2 0.2823352E-09 3 0.2385196E-09 4 0.1800236E-09 5 0.7770571E-10 6 0.4892475E-10 7 0.4052000E-10 8 0.3605219E-11 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.2474968E-12 1 0.1755312E-08 2 0.4252450E-08 3 0.3165157E-09 4 0.9187562E-09 5 0.1312703E-09 6 0.1192019E-09 7 0.8222358E-10 8 0.7405854E-11 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1197374E-09 1 0.5460089E-08 2 0.9201673E-08 3 0.3497339E-08 4 0.5909185E-08 5 0.1740113E-08 6 0.4938564E-09 7 0.1225041E-09 8 0.5915177E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.1075557E-12 1 0.1299224E-08 2 0.2896130E-07 3 0.4447022E-07 4 0.3245787E-07 5 0.4021744E-08 6 0.9827788E-09 7 0.5510412E-09 8 0.3001047E-10 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.6870361E-14 1 0.2474201E-06 2 0.2242794E-06 3 0.1046078E-05 4 0.3197955E-06 5 0.6047727E-08 6 0.3869392E-08 7 0.8549487E-09 8 0.1480958E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.6131070E-06 1 0.5073791E-06 2 0.2736529E-05 3 0.1463252E-04 4 0.3099126E-05 5 0.7570602E-07 6 0.9709742E-08 7 0.4901466E-08 8 0.3008431E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1642713E-12 1 0.3614551E-05 2 0.1694837E-03 3 0.1922994E-03 4 0.2120440E-04 5 0.6180479E-06 6 0.2809954E-07 7 0.5384114E-08 8 0.6761403E-09 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.8403918E-11 1 0.2557515E-04 2 0.2244563E-02 3 0.1438428E-02 4 0.9179942E-04 5 0.3389053E-05 6 0.8035970E-07 7 0.1172763E-07 8 0.1330497E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.3718712E-05 1 0.4479817E-02 2 0.1824506E-01 3 0.5414511E-02 4 0.2598522E-03 5 0.1452628E-04 6 0.3212286E-06 7 0.1603924E-07 8 0.2549701E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2654135E-10 1 0.2712381E-01 2 0.6464249E-01 3 0.8676261E-02 4 0.8079010E-03 5 0.7981760E-04 6 0.1562789E-05 7 0.2349439E-07 8 0.1504213E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.1280061E-12 1 0.5509162E-01 2 0.8086017E-01 3 0.7008263E-02 4 0.4209849E-02 5 0.3495212E-03 6 0.6650867E-05 7 0.3560856E-07 8 0.5408111E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1297807E+00 1 0.4265746E-01 2 0.1021496E-01 3 0.4437263E-01 4 0.9829174E-02 5 0.7714715E-03 6 0.1998070E-04 7 0.4513790E-07 8 0.2964295E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2571705E-13 1 0.4555114E-03 2 0.8914019E-01 3 0.1662311E-01 4 0.9870023E-02 5 0.1826867E-02 6 0.4933950E-04 7 0.1053261E-06 8 0.3522452E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.7487566E-11 1 0.9633693E-03 2 0.3852395E-01 3 0.5625396E-01 4 0.2791160E-01 5 0.4884992E-02 6 0.1161939E-03 7 0.3873613E-06 8 0.4430343E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.2831668E-06 1 0.4056944E-03 2 0.2231347E-01 3 0.8034783E-01 4 0.7411363E-01 5 0.1374718E-01 6 0.3619502E-03 7 0.8552308E-06 8 0.1716637E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.5554331E-14 1 0.2469864E-13 2 0.1029299E-11 3 0.5671479E-11 4 0.2356133E-11 5 0.8151989E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.9337717E-15 1 0.1370008E-12 2 0.2800274E-12 3 0.1694218E-11 4 0.1466063E-11 5 0.2236523E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.1438241E-14 1 0.2658555E-11 2 0.3782996E-12 3 0.1687116E-11 4 0.1971268E-11 5 0.1838401E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.3245095E-12 1 0.1336045E-12 2 0.3439479E-11 3 0.4024311E-11 4 0.2247913E-11 5 0.3778638E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.3190359E-15 1 0.1376375E-11 2 0.2014774E-10 3 0.1889480E-11 4 0.6820164E-11 5 0.5622740E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2417717E-15 1 0.1079925E-10 2 0.5638710E-10 3 0.1212744E-10 4 0.2307429E-10 5 0.6710018E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2429290E-11 1 0.2002149E-09 2 0.9346631E-10 3 0.1609983E-09 4 0.1379169E-09 5 0.2240171E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.7923728E-16 1 0.5347736E-09 2 0.1248389E-08 3 0.9488797E-09 4 0.5421036E-09 5 0.1337449E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.4636018E-16 1 0.1573114E-08 2 0.2538666E-08 3 0.1893931E-08 4 0.1408557E-08 5 0.3613615E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.3924242E-09 1 0.4720237E-08 2 0.1324784E-08 3 0.5725199E-08 4 0.4301726E-08 5 0.2034641E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1368387E-16 1 0.2066091E-08 2 0.1208608E-07 3 0.2369922E-07 4 0.1937096E-07 5 0.1863508E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.9132200E-15 1 0.3527767E-07 2 0.1875468E-06 3 0.1419315E-06 4 0.3031293E-07 5 0.2060918E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.1875013E-08 1 0.2618689E-06 2 0.1710409E-05 3 0.1346988E-06 4 0.1095147E-06 5 0.9775692E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.7928955E-14 1 0.1127608E-05 2 0.3264963E-05 3 0.2506429E-06 4 0.8006512E-07 5 0.3396674E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.3257640E-16 1 0.1652082E-04 2 0.8370900E-05 3 0.8422105E-06 4 0.6694623E-07 5 0.2541904E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.7703319E-04 1 0.9242008E-04 2 0.2383178E-04 3 0.1562880E-05 4 0.5187036E-07 5 0.1595536E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.7273506E-15 1 0.3263610E-04 2 0.1301045E-04 3 0.9829904E-06 4 0.1420174E-06 5 0.2559514E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1820241E-13 1 0.3101588E-05 2 0.3975756E-06 3 0.2775381E-06 4 0.1018655E-06 5 0.6470184E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.7910051E-07 1 0.3500548E-06 2 0.1101156E-06 3 0.1035828E-06 4 0.1154987E-06 5 0.3334267E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.6266101E-13 1 0.1436077E-06 2 0.5375890E-06 3 0.3822200E-06 4 0.7293930E-07 5 0.3739463E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.8203876E-14 1 0.4970337E-06 2 0.3128747E-06 3 0.1514542E-06 4 0.1525443E-06 5 0.8457348E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.8307506E-13 1 0.4855978E-06 2 0.2154931E-05 3 0.4012992E-05 4 0.4351415E-06 5 0.1712726E-06 6 0.2355240E-07 7 0.3149634E-08 8 0.3440840E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.6279008E-13 1 0.4038365E-07 2 0.2230835E-06 3 0.2168354E-06 4 0.2684041E-06 5 0.2476619E-07 6 0.2811317E-08 7 0.1708113E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.5861160E-07 1 0.5162760E-07 2 0.6139660E-06 3 0.1188318E-05 4 0.4187437E-07 5 0.1730987E-07 6 0.4092744E-08 7 0.1063667E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.3499300E-12 1 0.3034879E-06 2 0.6472155E-05 3 0.1269778E-05 4 0.4454260E-06 5 0.4853502E-07 6 0.9391073E-08 7 0.1770492E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.1980429E-12 1 0.1624247E-06 2 0.3081546E-04 3 0.3844582E-05 4 0.4207846E-05 5 0.3987857E-06 6 0.1345056E-07 7 0.1234667E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.9317605E-08 1 0.5755305E-05 2 0.2007978E-04 3 0.6578849E-05 4 0.8457585E-05 5 0.3688193E-05 6 0.6062805E-07 7 0.8263386E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3564803E-11 1 0.1086641E-08 2 0.4728333E-08 3 0.2093609E-08 4 0.8969245E-09 5 0.2495104E-09 6 0.2182009E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1361645E-13 1 0.1589834E-08 2 0.1572771E-08 3 0.5476542E-08 4 0.2899154E-08 5 0.3778076E-09 6 0.3274043E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.5604772E-13 1 0.4346310E-08 2 0.1162078E-07 3 0.8533168E-08 4 0.4538739E-08 5 0.2282943E-08 6 0.1410033E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.6900526E-07 1 0.3753280E-07 2 0.1844830E-06 3 0.2407226E-06 4 0.2020674E-07 5 0.2688646E-08 6 0.4484192E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.8031141E-13 1 0.1442437E-07 2 0.2910529E-05 3 0.2207870E-05 4 0.1742049E-06 5 0.8187146E-08 6 0.1899299E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.9821879E-12 1 0.4553882E-05 2 0.2832191E-04 3 0.1200513E-04 4 0.9677016E-06 5 0.2433440E-07 6 0.1121865E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.4449056E-07 1 0.5314040E-04 2 0.2062010E-03 3 0.4939960E-04 4 0.2593455E-05 5 0.5828625E-07 6 0.1672576E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.5429146E-12 1 0.4493662E-03 2 0.6166338E-03 3 0.1542250E-03 4 0.1409163E-04 5 0.4643267E-06 6 0.9216120E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1632036E-13 1 0.2181452E-03 2 0.1191266E-03 3 0.1099905E-03 4 0.4615330E-04 5 0.1133073E-05 6 0.7031606E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1955773E-14 1 0.1480875E-11 2 0.1545105E-11 3 0.4755786E-11 4 0.1122638E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.1545826E-15 1 0.1508940E-11 2 0.6048245E-11 3 0.4481953E-11 4 0.1553040E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1326592E-11 1 0.1914530E-11 2 0.2666408E-10 3 0.3476352E-10 4 0.2287394E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.7089987E-16 1 0.2479350E-10 2 0.7406583E-10 3 0.1194240E-09 4 0.1290229E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.1199519E-15 1 0.3665522E-09 2 0.4775262E-09 3 0.2131514E-09 4 0.9805495E-10 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.9196708E-09 1 0.3943822E-08 2 0.8138965E-09 3 0.1646081E-08 4 0.7810417E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.4828862E-15 1 0.1355134E-08 2 0.2450853E-08 3 0.2072036E-08 4 0.7338806E-09 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.6899002E-14 1 0.3045458E-07 2 0.3894920E-07 3 0.2228228E-07 4 0.4502972E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.1774577E-08 1 0.1464403E-06 2 0.6118028E-06 3 0.6320322E-07 4 0.6344649E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.7726595E-14 1 0.3807781E-05 2 0.4413789E-05 3 0.2813263E-06 4 0.2095712E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.2894151E-16 1 0.4714973E-04 2 0.2862126E-04 3 0.7774275E-06 4 0.1059759E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.1325594E-03 1 0.2872253E-03 2 0.4454182E-04 3 0.5446152E-06 4 0.5187783E-08 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.4832373E-15 1 0.1269464E-03 2 0.9332366E-04 3 0.5800674E-05 4 0.5415399E-07 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9982080 average vibrational energy (ev) = 0.001517 average rotational energy (ev) = 0.485602 average diffraction energy (ev) = 0.043592 the reaction probability = 0.1791993D-02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9533100E+00 0.5092400E-01 0.4779968E+00 1 0.3388921E-01 0.2565461E-01 0.2652999E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.4704998E-03 0 31 2 -2 0.1362774E-03 0 37 2 -1 0.3179315E-03 0 44 2 0 0.4738835E-03 0 50 2 1 0.1300661E-02 0 56 2 2 0.7965163E-03 0 21 4 -4 0.7190814E-04 0 26 4 -3 0.1268550E-03 0 32 4 -2 0.3786235E-03 0 38 4 -1 0.5032957E-03 0 45 4 0 0.4743256E-03 0 51 4 1 0.5973369E-03 0 57 4 2 0.3300282E-02 0 62 4 3 0.2050691E-02 0 67 4 4 0.1916426E-02 0 13 6 -6 0.2070164E-04 0 17 6 -5 0.1599516E-04 0 22 6 -4 0.2770297E-04 0 27 6 -3 0.8169470E-04 0 33 6 -2 0.2275233E-03 0 39 6 -1 0.1002395E-02 0 46 6 0 0.2932498E-02 0 52 6 1 0.6182480E-02 0 58 6 2 0.6697996E-02 0 63 6 3 0.9988372E-02 0 68 6 4 0.1067106E-01 0 72 6 5 0.9793915E-02 0 76 6 6 0.1048474E-01 0 7 8 -8 0.5557388E-06 0 10 8 -7 0.2836614E-06 0 14 8 -6 0.1101615E-06 0 18 8 -5 0.2256872E-06 0 23 8 -4 0.3750626E-06 0 28 8 -3 0.1462073E-05 0 34 8 -2 0.1675155E-04 0 40 8 -1 0.1547963E-03 0 47 8 0 0.1710361E-02 0 53 8 1 0.1147950E-01 0 59 8 2 0.5180776E-01 0 64 8 3 0.1043402E+00 0 69 8 4 0.8496076E-01 0 73 8 5 0.2152303E+00 0 77 8 6 0.8116511E-01 0 80 8 7 0.1190624E+00 0 83 8 8 0.2110381E+00 0 3 10 -10 0.2710540E-10 0 5 10 -9 0.4134657E-10 0 8 10 -8 0.3786270E-10 0 11 10 -7 0.6048859E-10 0 15 10 -6 0.2770078E-09 0 19 10 -5 0.5661688E-09 0 24 10 -4 0.2998476E-08 0 29 10 -3 0.9864511E-08 0 35 10 -2 0.1386781E-07 0 41 10 -1 0.6511380E-07 0 48 10 0 0.6414491E-06 0 54 10 1 0.3437055E-05 0 60 10 2 0.1711699E-04 0 65 10 3 0.3777479E-04 0 70 10 4 0.2623883E-03 0 74 10 5 0.5543726E-03 0 78 10 6 0.3677869E-03 0 81 10 7 0.4260798E-04 0 84 10 8 0.5226435E-05 0 86 10 9 0.2143195E-05 0 88 10 10 0.4768453E-05 0 1 12 -12 0.0000000E+00 0 2 12 -11 0.0000000E+00 0 4 12 -10 0.0000000E+00 0 6 12 -9 0.0000000E+00 0 9 12 -8 0.0000000E+00 0 12 12 -7 0.0000000E+00 0 16 12 -6 0.0000000E+00 0 20 12 -5 0.0000000E+00 0 25 12 -4 0.0000000E+00 0 30 12 -3 0.0000000E+00 0 36 12 -2 0.0000000E+00 0 42 12 -1 0.0000000E+00 0 49 12 0 0.0000000E+00 0 55 12 1 0.0000000E+00 0 61 12 2 0.0000000E+00 0 66 12 3 0.0000000E+00 0 71 12 4 0.0000000E+00 0 75 12 5 0.0000000E+00 0 79 12 6 0.0000000E+00 0 82 12 7 0.0000000E+00 0 85 12 8 0.0000000E+00 0 87 12 9 0.0000000E+00 0 89 12 10 0.0000000E+00 0 90 12 11 0.0000000E+00 0 91 12 12 0.0000000E+00 1 43 0 0 0.7254415E-04 1 31 2 -2 0.5156981E-04 1 37 2 -1 0.3257724E-04 1 44 2 0 0.5204697E-04 1 50 2 1 0.2004818E-03 1 56 2 2 0.3135762E-03 1 21 4 -4 0.6998197E-05 1 26 4 -3 0.1596463E-05 1 32 4 -2 0.2811217E-05 1 38 4 -1 0.9701872E-05 1 45 4 0 0.6220254E-04 1 51 4 1 0.3374892E-03 1 57 4 2 0.1125812E-02 1 62 4 3 0.2087018E-02 1 67 4 4 0.1762254E-02 1 13 6 -6 0.2874895E-07 1 17 6 -5 0.3289576E-08 1 22 6 -4 0.5929625E-08 1 27 6 -3 0.3433779E-08 1 33 6 -2 0.5075741E-08 1 39 6 -1 0.4005209E-07 1 46 6 0 0.3273648E-06 1 52 6 1 0.3456024E-05 1 58 6 2 0.2356871E-04 1 63 6 3 0.1764548E-03 1 68 6 4 0.6017873E-03 1 72 6 5 0.1615124E-02 1 76 6 6 0.2534972E-01 1 7 8 -8 0.3111129E-13 1 10 8 -7 0.7413049E-12 1 14 8 -6 0.2136605E-13 1 18 8 -5 0.1925234E-13 1 23 8 -4 0.7703676E-13 1 28 8 -3 0.6521556E-13 1 34 8 -2 0.1055936E-12 1 40 8 -1 0.7117010E-11 1 47 8 0 0.6956520E-13 1 53 8 1 0.1187011E-10 1 59 8 2 0.4211796E-10 1 64 8 3 0.2880265E-10 1 69 8 4 0.4714879E-10 1 73 8 5 0.9933957E-09 1 77 8 6 0.3474172E-09 1 80 8 7 0.2580516E-10 1 83 8 8 0.4174957E-09 1 3 10 -10 0.0000000E+00 1 5 10 -9 0.0000000E+00 1 8 10 -8 0.0000000E+00 1 11 10 -7 0.0000000E+00 1 15 10 -6 0.0000000E+00 1 19 10 -5 0.0000000E+00 1 24 10 -4 0.0000000E+00 1 29 10 -3 0.0000000E+00 1 35 10 -2 0.0000000E+00 1 41 10 -1 0.0000000E+00 1 48 10 0 0.0000000E+00 1 54 10 1 0.0000000E+00 1 60 10 2 0.0000000E+00 1 65 10 3 0.0000000E+00 1 70 10 4 0.0000000E+00 1 74 10 5 0.0000000E+00 1 78 10 6 0.0000000E+00 1 81 10 7 0.0000000E+00 1 84 10 8 0.0000000E+00 1 86 10 9 0.0000000E+00 1 88 10 10 0.0000000E+00 1 1 12 -12 0.0000000E+00 1 2 12 -11 0.0000000E+00 1 4 12 -10 0.0000000E+00 1 6 12 -9 0.0000000E+00 1 9 12 -8 0.0000000E+00 1 12 12 -7 0.0000000E+00 1 16 12 -6 0.0000000E+00 1 20 12 -5 0.0000000E+00 1 25 12 -4 0.0000000E+00 1 30 12 -3 0.0000000E+00 1 36 12 -2 0.0000000E+00 1 42 12 -1 0.0000000E+00 1 49 12 0 0.0000000E+00 1 55 12 1 0.0000000E+00 1 61 12 2 0.0000000E+00 1 66 12 3 0.0000000E+00 1 71 12 4 0.0000000E+00 1 75 12 5 0.0000000E+00 1 79 12 6 0.0000000E+00 1 82 12 7 0.0000000E+00 1 85 12 8 0.0000000E+00 1 87 12 9 0.0000000E+00 1 89 12 10 0.0000000E+00 1 90 12 11 0.0000000E+00 1 91 12 12 0.0000000E+00 2 43 0 0 0.0000000E+00 2 31 2 -2 0.0000000E+00 2 37 2 -1 0.0000000E+00 2 44 2 0 0.0000000E+00 2 50 2 1 0.0000000E+00 2 56 2 2 0.0000000E+00 2 21 4 -4 0.0000000E+00 2 26 4 -3 0.0000000E+00 2 32 4 -2 0.0000000E+00 2 38 4 -1 0.0000000E+00 2 45 4 0 0.0000000E+00 2 51 4 1 0.0000000E+00 2 57 4 2 0.0000000E+00 2 62 4 3 0.0000000E+00 2 67 4 4 0.0000000E+00 2 13 6 -6 0.0000000E+00 2 17 6 -5 0.0000000E+00 2 22 6 -4 0.0000000E+00 2 27 6 -3 0.0000000E+00 2 33 6 -2 0.0000000E+00 2 39 6 -1 0.0000000E+00 2 46 6 0 0.0000000E+00 2 52 6 1 0.0000000E+00 2 58 6 2 0.0000000E+00 2 63 6 3 0.0000000E+00 2 68 6 4 0.0000000E+00 2 72 6 5 0.0000000E+00 2 76 6 6 0.0000000E+00 2 7 8 -8 0.0000000E+00 2 10 8 -7 0.0000000E+00 2 14 8 -6 0.0000000E+00 2 18 8 -5 0.0000000E+00 2 23 8 -4 0.0000000E+00 2 28 8 -3 0.0000000E+00 2 34 8 -2 0.0000000E+00 2 40 8 -1 0.0000000E+00 2 47 8 0 0.0000000E+00 2 53 8 1 0.0000000E+00 2 59 8 2 0.0000000E+00 2 64 8 3 0.0000000E+00 2 69 8 4 0.0000000E+00 2 73 8 5 0.0000000E+00 2 77 8 6 0.0000000E+00 2 80 8 7 0.0000000E+00 2 83 8 8 0.0000000E+00 2 3 10 -10 0.0000000E+00 2 5 10 -9 0.0000000E+00 2 8 10 -8 0.0000000E+00 2 11 10 -7 0.0000000E+00 2 15 10 -6 0.0000000E+00 2 19 10 -5 0.0000000E+00 2 24 10 -4 0.0000000E+00 2 29 10 -3 0.0000000E+00 2 35 10 -2 0.0000000E+00 2 41 10 -1 0.0000000E+00 2 48 10 0 0.0000000E+00 2 54 10 1 0.0000000E+00 2 60 10 2 0.0000000E+00 2 65 10 3 0.0000000E+00 2 70 10 4 0.0000000E+00 2 74 10 5 0.0000000E+00 2 78 10 6 0.0000000E+00 2 81 10 7 0.0000000E+00 2 84 10 8 0.0000000E+00 2 86 10 9 0.0000000E+00 2 88 10 10 0.0000000E+00 2 1 12 -12 0.0000000E+00 2 2 12 -11 0.0000000E+00 2 4 12 -10 0.0000000E+00 2 6 12 -9 0.0000000E+00 2 9 12 -8 0.0000000E+00 2 12 12 -7 0.0000000E+00 2 16 12 -6 0.0000000E+00 2 20 12 -5 0.0000000E+00 2 25 12 -4 0.0000000E+00 2 30 12 -3 0.0000000E+00 2 36 12 -2 0.0000000E+00 2 42 12 -1 0.0000000E+00 2 49 12 0 0.0000000E+00 2 55 12 1 0.0000000E+00 2 61 12 2 0.0000000E+00 2 66 12 3 0.0000000E+00 2 71 12 4 0.0000000E+00 2 75 12 5 0.0000000E+00 2 79 12 6 0.0000000E+00 2 82 12 7 0.0000000E+00 2 85 12 8 0.0000000E+00 2 87 12 9 0.0000000E+00 2 89 12 10 0.0000000E+00 2 90 12 11 0.0000000E+00 2 91 12 12 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 0 0 0 0.5232056E-11 1 0.5426056E-06 2 0.1797974E-04 3 0.7481814E-04 4 0.1504818E-03 5 0.6390356E-04 6 0.8503814E-04 7 0.5927628E-04 8 0.1684963E-04 9 0.1609837E-05 v, j, mj = 0 2 -2 0 0.3189755E-12 1 0.3271099E-05 2 0.1015573E-04 3 0.2193523E-04 4 0.2283974E-04 5 0.2169359E-04 6 0.3116044E-04 7 0.1974080E-04 8 0.5112110E-05 9 0.3686398E-06 v, j, mj = 0 2 -1 0 0.4080688E-05 1 0.4748277E-06 2 0.8799427E-05 3 0.6258616E-04 4 0.1329890E-03 5 0.7074892E-04 6 0.2775628E-04 7 0.8726250E-05 8 0.1692150E-05 9 0.7784084E-07 v, j, mj = 0 2 0 0 0.2333020E-10 1 0.5417449E-06 2 0.3437736E-04 3 0.7864594E-04 4 0.1434637E-03 5 0.1202338E-03 6 0.6212198E-04 7 0.2644741E-04 8 0.7411295E-05 9 0.6402154E-06 v, j, mj = 0 2 1 0 0.1082341E-11 1 0.3099295E-04 2 0.1599121E-03 3 0.2898123E-03 4 0.4373554E-03 5 0.2131598E-03 6 0.1126026E-03 7 0.4564594E-04 8 0.1061033E-04 9 0.5692911E-06 v, j, mj = 0 2 2 0 0.3469284E-08 1 0.6113617E-05 2 0.9239628E-04 3 0.1927839E-03 4 0.6250009E-04 5 0.3817555E-04 6 0.1570758E-03 7 0.1717604E-03 8 0.6863329E-04 9 0.7073827E-05 v, j, mj = 0 4 -4 0 0.2096996E-09 1 0.8218748E-06 2 0.8047161E-05 3 0.8406602E-05 4 0.1089256E-04 5 0.1981344E-04 6 0.1607741E-04 7 0.6802504E-05 8 0.1020089E-05 9 0.2628562E-07 v, j, mj = 0 4 -3 0 0.3030944E-11 1 0.2845877E-05 2 0.7014379E-05 3 0.1787901E-04 4 0.5654189E-04 5 0.3104384E-04 6 0.9799692E-05 7 0.1600044E-05 8 0.1255629E-06 9 0.4696707E-08 v, j, mj = 0 4 -2 0 0.4006029E-11 1 0.1434150E-05 2 0.9049656E-05 3 0.8565991E-04 4 0.2069563E-03 5 0.6190279E-04 6 0.1145405E-04 7 0.1953105E-05 8 0.2029505E-06 9 0.1054205E-07 v, j, mj = 0 4 -1 0 0.4558041E-05 1 0.9503558E-05 2 0.1355912E-04 3 0.2266153E-03 4 0.2040273E-03 5 0.3978687E-04 6 0.3555017E-05 7 0.1444026E-05 8 0.2401451E-06 9 0.6352768E-08 v, j, mj = 0 4 0 0 0.1549521E-11 1 0.8917287E-05 2 0.7998108E-04 3 0.2729700E-03 4 0.7668179E-04 5 0.1939390E-04 6 0.1207745E-04 7 0.3632047E-05 8 0.6445535E-06 9 0.2749029E-07 v, j, mj = 0 4 1 0 0.1308954E-10 1 0.1989849E-05 2 0.1166579E-03 3 0.1889170E-03 4 0.1699391E-03 5 0.6622897E-04 6 0.3934258E-04 7 0.1234786E-04 8 0.1877107E-05 9 0.3656794E-07 v, j, mj = 0 4 2 0 0.2755922E-06 1 0.1219312E-03 2 0.9112605E-03 3 0.9482110E-03 4 0.6058819E-03 5 0.4213252E-03 6 0.2141920E-03 7 0.6905254E-04 8 0.7953911E-05 9 0.1978845E-06 v, j, mj = 0 4 3 0 0.5511338E-11 1 0.6442755E-03 2 0.8799529E-04 3 0.2104215E-03 4 0.4648357E-03 5 0.2663013E-03 6 0.2475528E-03 7 0.1153183E-03 8 0.1383763E-04 9 0.1531379E-06 v, j, mj = 0 4 4 0 0.1459312E-12 1 0.2443807E-03 2 0.4006510E-03 3 0.6510086E-04 4 0.4696938E-04 5 0.1956834E-03 6 0.5058328E-03 7 0.3823911E-03 8 0.7351099E-04 9 0.1905428E-05 v, j, mj = 0 6 -6 0 0.1446648E-10 1 0.4353807E-06 2 0.1312952E-05 3 0.2174216E-05 4 0.4778919E-05 5 0.6836736E-05 6 0.4310684E-05 7 0.8307372E-06 8 0.2175546E-07 9 0.2486644E-09 v, j, mj = 0 6 -5 0 0.4282660E-11 1 0.1716390E-05 2 0.2111762E-05 3 0.3305411E-05 4 0.4090340E-05 5 0.3330377E-05 6 0.1273488E-05 7 0.1639026E-06 8 0.3007679E-08 9 0.4740415E-09 v, j, mj = 0 6 -4 0 0.5191528E-08 1 0.6660207E-06 2 0.3684399E-05 3 0.1007818E-04 4 0.1123387E-04 5 0.1784459E-05 6 0.2364942E-06 7 0.1237325E-07 8 0.1386229E-08 9 0.5949454E-09 v, j, mj = 0 6 -3 0 0.8743120E-13 1 0.4504986E-05 2 0.7146883E-05 3 0.3077800E-04 4 0.3582061E-04 5 0.3247021E-05 6 0.1755947E-06 7 0.1869534E-07 8 0.2359850E-08 9 0.5450684E-09 v, j, mj = 0 6 -2 0 0.5548401E-12 1 0.5977026E-05 2 0.1660987E-04 3 0.1234973E-03 4 0.7789263E-04 5 0.3408210E-05 6 0.1083857E-06 7 0.2684451E-07 8 0.2589709E-08 9 0.4533754E-09 v, j, mj = 0 6 -1 0 0.3719438E-04 1 0.1524808E-04 2 0.1599810E-03 3 0.6667570E-03 4 0.1206608E-03 5 0.2389542E-05 6 0.1315056E-06 7 0.2684141E-07 8 0.5115240E-08 9 0.9342107E-09 v, j, mj = 0 6 0 0 0.5918078E-12 1 0.3636482E-04 2 0.9545830E-03 3 0.1784739E-02 4 0.1521342E-03 5 0.4108148E-05 6 0.4650477E-06 7 0.9488706E-07 8 0.7360008E-08 9 0.9641971E-09 v, j, mj = 0 6 1 0 0.1492373E-10 1 0.2509938E-03 2 0.4018443E-02 3 0.1749351E-02 4 0.1425832E-03 5 0.1771623E-04 6 0.2853404E-05 7 0.5148310E-06 8 0.2132633E-07 9 0.2920367E-08 v, j, mj = 0 6 2 0 0.3080478E-05 1 0.8547018E-03 2 0.4077453E-02 3 0.1288807E-02 4 0.2899843E-03 5 0.1511304E-03 6 0.2974506E-04 7 0.2964860E-05 8 0.1249806E-06 9 0.4511887E-08 v, j, mj = 0 6 3 0 0.4802727E-11 1 0.2613187E-02 2 0.2017586E-02 3 0.3416465E-02 4 0.1185883E-02 5 0.5992905E-03 6 0.1409791E-03 7 0.1448855E-04 8 0.4886334E-06 9 0.3981673E-08 v, j, mj = 0 6 4 0 0.1098156E-11 1 0.4257975E-02 2 0.1940220E-02 3 0.4333073E-03 4 0.2232597E-02 5 0.1372710E-02 6 0.3938293E-03 7 0.3912518E-04 8 0.1280232E-05 9 0.1388513E-07 v, j, mj = 0 6 5 0 0.3044400E-02 1 0.1070853E-02 2 0.1953173E-02 3 0.1070136E-02 4 0.1152224E-02 5 0.8759993E-03 6 0.5462158E-03 7 0.7876635E-04 8 0.2126321E-05 9 0.2071648E-07 v, j, mj = 0 6 6 0 0.1437246E-11 1 0.7639361E-03 2 0.2520603E-02 3 0.1590686E-02 4 0.1314672E-02 5 0.2291101E-02 6 0.1670411E-02 7 0.3242007E-03 8 0.9100822E-05 9 0.2556782E-07 v, j, mj = 0 8 -8 0 0.1407483E-11 1 0.7950779E-08 2 0.9851787E-08 3 0.7690391E-07 4 0.2613111E-06 5 0.1820560E-06 6 0.1741188E-07 7 0.2157764E-09 8 0.3620240E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1148285E-07 1 0.1048466E-07 2 0.6009230E-08 3 0.4357788E-07 4 0.1309691E-06 5 0.7323058E-07 6 0.7677701E-08 7 0.1805476E-09 8 0.4880704E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.9056388E-12 1 0.9803171E-09 2 0.1982268E-07 3 0.3292349E-07 4 0.3848657E-07 5 0.1555132E-07 6 0.2154805E-08 7 0.1804845E-09 8 0.6087031E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1232472E-11 1 0.4380450E-07 2 0.1207011E-06 3 0.3875906E-07 4 0.1805096E-07 5 0.3639310E-08 6 0.4636936E-09 7 0.2051657E-09 8 0.6225580E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1325797E-08 1 0.6974977E-07 2 0.1003655E-06 3 0.1020397E-06 4 0.9069254E-07 5 0.9558257E-08 6 0.1067527E-08 7 0.1490949E-09 8 0.1144650E-09 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2184072E-12 1 0.1911740E-07 2 0.1754626E-06 3 0.7717038E-06 4 0.4694069E-06 5 0.2305824E-07 6 0.2642786E-08 7 0.4936266E-09 8 0.1878247E-09 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1204259E-14 1 0.3963758E-06 2 0.2011101E-05 3 0.1142983E-04 4 0.2882941E-05 5 0.2294433E-07 6 0.4984104E-08 7 0.2664252E-08 8 0.7068460E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.9583445E-06 1 0.1119180E-05 2 0.2580789E-04 3 0.1126289E-03 4 0.1414350E-04 5 0.1192684E-06 6 0.1298797E-07 7 0.5608542E-08 8 0.6217338E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.8398255E-12 1 0.1889091E-04 2 0.8305081E-03 3 0.8169102E-03 4 0.4314545E-04 5 0.8333087E-06 6 0.4772686E-07 7 0.2240639E-07 8 0.2434646E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.4328754E-10 1 0.1226947E-03 2 0.8163834E-02 3 0.3111628E-02 4 0.7434929E-04 5 0.6689265E-05 6 0.2894686E-06 7 0.9973525E-08 8 0.2392816E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1315850E-04 1 0.1168761E-01 2 0.3505815E-01 3 0.4761370E-02 4 0.2399598E-03 5 0.4585128E-04 6 0.1596047E-05 7 0.5782887E-07 8 0.5655436E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.7646316E-10 1 0.4465136E-01 2 0.5497096E-01 3 0.2310923E-02 4 0.2119511E-02 5 0.2765170E-03 6 0.1074844E-04 7 0.1527168E-06 8 0.9119980E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.4190895E-12 1 0.2309707E-01 2 0.3276407E-01 3 0.1993991E-01 4 0.8160073E-02 5 0.9553824E-03 6 0.4365972E-04 7 0.5853087E-06 8 0.6497077E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1017905E+00 1 0.2757217E-01 2 0.2429893E-01 3 0.4826985E-01 4 0.1082091E-01 5 0.2340343E-02 6 0.1356957E-03 7 0.1839607E-05 8 0.1389635E-07 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.8180001E-13 1 0.1453412E-01 2 0.3633071E-01 3 0.4657527E-02 4 0.1914743E-01 5 0.6156144E-02 6 0.3355490E-03 7 0.3614916E-05 8 0.8002351E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.3154224E-10 1 0.4296559E-02 2 0.5392651E-01 3 0.4559990E-01 4 0.9148207E-02 5 0.5541591E-02 6 0.5438930E-03 7 0.5752382E-05 8 0.1272633E-07 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3112096E-06 1 0.3452008E-03 2 0.3032247E-01 3 0.7453044E-01 4 0.7463299E-01 5 0.2916068E-01 6 0.2027846E-02 7 0.1814449E-04 8 0.4690037E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1376813E-13 1 0.8371442E-13 2 0.6079767E-11 3 0.7954233E-11 4 0.7087501E-11 5 0.4578874E-11 6 0.1307538E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.1321303E-13 1 0.2902954E-11 2 0.1662916E-10 3 0.6271732E-11 4 0.7962498E-11 5 0.4323022E-11 6 0.3243995E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.9009737E-14 1 0.3754817E-11 2 0.4920991E-11 3 0.1101808E-10 4 0.7604668E-11 5 0.9779269E-11 6 0.7758633E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.6005186E-11 1 0.6831265E-11 2 0.1502383E-10 3 0.1209659E-10 4 0.1030665E-10 5 0.6902880E-11 6 0.3322189E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.5034864E-14 1 0.3963083E-10 2 0.1142407E-09 3 0.5977765E-10 4 0.1659731E-10 5 0.3495653E-10 6 0.1179978E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.3050932E-14 1 0.2954590E-10 2 0.1446650E-09 3 0.2559107E-09 4 0.6495541E-10 5 0.6588097E-10 6 0.5207744E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.4352578E-10 1 0.7571744E-09 2 0.1004279E-08 3 0.6701382E-09 4 0.4485704E-09 5 0.6731492E-10 6 0.7473499E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.7592128E-15 1 0.3900271E-08 2 0.3487164E-08 3 0.1230745E-08 4 0.8223037E-09 5 0.4071829E-09 6 0.1684354E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.2069652E-15 1 0.4869612E-08 2 0.4108109E-08 3 0.3191430E-08 4 0.7418735E-09 5 0.8279610E-09 6 0.1288250E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.2991957E-08 1 0.5607346E-08 2 0.2426641E-07 3 0.2453411E-07 4 0.3794767E-08 5 0.3355965E-08 6 0.5632492E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.3699337E-15 1 0.1779466E-07 2 0.3287847E-06 3 0.2520122E-06 4 0.3103679E-07 5 0.1057771E-07 6 0.1243008E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.9267832E-14 1 0.6047118E-07 2 0.2348179E-05 3 0.9464687E-06 4 0.6280243E-07 5 0.1555812E-07 6 0.3575355E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.5322720E-08 1 0.3219912E-05 2 0.1237847E-04 3 0.1343104E-05 4 0.1241851E-06 5 0.4457422E-07 6 0.1425152E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.2537253E-13 1 0.1015384E-04 2 0.2444563E-04 3 0.2992728E-05 4 0.1672007E-06 5 0.1276216E-07 6 0.2618382E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.7350008E-15 1 0.1705711E-03 2 0.8125091E-04 3 0.1029142E-04 4 0.2303424E-06 5 0.3919001E-07 6 0.5386889E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.2510300E-03 1 0.2149281E-03 2 0.8240300E-04 3 0.5850495E-05 4 0.1003102E-06 5 0.5282780E-07 6 0.7861871E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.6961063E-14 1 0.2461415E-03 2 0.1129862E-03 3 0.8189433E-05 4 0.3833370E-06 5 0.7960646E-07 6 0.6803159E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1176194E-12 1 0.3346497E-04 2 0.6243621E-05 3 0.2285457E-05 4 0.5417493E-06 5 0.6005373E-07 6 0.1212801E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.6606777E-07 1 0.2016206E-05 2 0.2599866E-05 3 0.2995837E-06 4 0.1289271E-06 5 0.1086801E-06 6 0.7104187E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1600862E-12 1 0.3241101E-06 2 0.4487768E-06 3 0.8738719E-06 4 0.3745518E-06 5 0.7188230E-07 6 0.5000147E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1150540E-13 1 0.1009186E-05 2 0.2290889E-05 3 0.1180312E-05 4 0.1031541E-06 5 0.1211000E-06 6 0.6381167E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.9921192E-11 1 0.3735184E-06 2 0.5392276E-05 3 0.1969241E-04 4 0.2684923E-04 5 0.1850787E-04 6 0.1700152E-05 7 0.2749871E-07 8 0.1185003E-08 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.6541884E-12 1 0.1194668E-05 2 0.3963515E-05 3 0.7575786E-05 4 0.1741078E-04 5 0.2025496E-04 6 0.1165392E-05 7 0.4081160E-08 8 0.6217732E-09 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.3894857E-05 1 0.1432307E-05 2 0.9134518E-05 3 0.1281834E-04 4 0.3365844E-05 5 0.1786114E-05 6 0.1439936E-06 7 0.1143762E-08 8 0.1137353E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.7966012E-11 1 0.6947353E-06 2 0.2823057E-04 3 0.6909072E-05 4 0.5848424E-05 5 0.9390657E-05 6 0.9650228E-06 7 0.8004411E-08 8 0.4714750E-09 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2034459E-11 1 0.1885006E-04 2 0.1123159E-03 3 0.1349875E-04 4 0.3889544E-04 5 0.1669329E-04 6 0.2228677E-06 7 0.4896529E-08 8 0.5008150E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.5676336E-07 1 0.1008417E-04 2 0.1120059E-03 3 0.3516955E-04 4 0.3719578E-04 5 0.1092685E-03 6 0.9744209E-05 7 0.5072920E-07 8 0.5247491E-09 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.6190412E-08 1 0.2698981E-06 2 0.6489167E-07 3 0.1746199E-05 4 0.4449697E-05 5 0.4582834E-06 6 0.2613706E-08 7 0.4232505E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1016023E-11 1 0.3279066E-06 2 0.8270091E-07 3 0.7001009E-06 4 0.4707727E-06 5 0.1371738E-07 6 0.1131473E-08 7 0.1316231E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2106709E-12 1 0.7404821E-08 2 0.6539008E-06 3 0.1088450E-05 4 0.5429775E-06 5 0.5042587E-06 6 0.1411418E-07 7 0.1106885E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1386294E-05 1 0.1862160E-06 2 0.3731671E-05 3 0.4082135E-05 4 0.2267872E-06 5 0.8346453E-07 6 0.4766861E-08 7 0.5370227E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.2220803E-12 1 0.3703631E-06 2 0.3980762E-04 3 0.2031613E-04 4 0.1545517E-05 5 0.1505459E-06 6 0.1032550E-07 7 0.2038014E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.3428051E-11 1 0.4251005E-04 2 0.2246081E-03 3 0.5943173E-04 4 0.9758457E-05 5 0.1166099E-05 6 0.1337533E-07 7 0.1374499E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.3140686E-06 1 0.2070562E-03 2 0.7017564E-03 3 0.1908488E-03 4 0.2300569E-04 5 0.2747482E-05 6 0.7872407E-07 7 0.4812106E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.1899575E-11 1 0.5692569E-03 2 0.8691336E-03 3 0.4564315E-03 4 0.1786972E-03 5 0.1338667E-04 6 0.1078605E-06 7 0.4604380E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.5641673E-13 1 0.9338266E-03 2 0.1642276E-03 3 0.8507367E-04 4 0.5074460E-03 5 0.7103249E-04 6 0.6444154E-06 7 0.2760194E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1506196E-12 1 0.1050763E-07 2 0.1549021E-07 3 0.2644376E-08 4 0.6102552E-10 5 0.4555243E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.1730425E-12 1 0.3693915E-09 2 0.4880223E-09 3 0.2024774E-08 4 0.3652304E-09 5 0.4198423E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.4884219E-11 1 0.2930975E-09 2 0.1513578E-08 3 0.3107742E-08 4 0.9410418E-09 5 0.6928137E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.9216803E-15 1 0.1163563E-08 2 0.3076069E-09 3 0.1555917E-08 4 0.3424470E-09 5 0.6424462E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.9930106E-15 1 0.1471753E-08 2 0.1856254E-08 3 0.9390928E-09 4 0.3238853E-09 5 0.4847546E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.4712512E-08 1 0.2113282E-08 2 0.2465962E-07 3 0.6559226E-08 4 0.1466213E-08 5 0.5412378E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.5497712E-14 1 0.1772849E-07 2 0.1880296E-06 3 0.1097541E-06 4 0.1111241E-07 5 0.7401741E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.7521328E-13 1 0.4548783E-06 2 0.2276991E-05 3 0.7024676E-06 4 0.1815614E-07 5 0.3531007E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.5541572E-08 1 0.3803372E-05 2 0.1706658E-04 3 0.2647781E-05 4 0.3419539E-07 5 0.1124375E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.4954869E-12 1 0.7828078E-04 2 0.9050937E-04 3 0.7527228E-05 4 0.1037608E-06 5 0.3362729E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.2750935E-13 1 0.3410191E-03 2 0.2515803E-03 3 0.9009487E-05 4 0.1422036E-06 5 0.3624642E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.1448451E-03 1 0.7803030E-03 2 0.5687251E-03 3 0.1172037E-03 4 0.4004832E-05 5 0.4260474E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.9391318E-13 1 0.1094694E-01 2 0.1253161E-01 3 0.1836047E-02 4 0.3500545E-04 5 0.1103995E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.1686431E-16 1 0.3109443E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -7 0 0.7173341E-12 1 0.2397076E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -6 0 0.1314182E-16 1 0.2135291E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -5 0 0.1230827E-16 1 0.1924004E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -4 0 0.6105045E-13 1 0.1598632E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -3 0 0.1348806E-17 1 0.6521421E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -2 0 0.6054261E-18 1 0.1055930E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -1 0 0.6548043E-11 1 0.5689665E-12 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 0 0 0.1142799E-17 1 0.6956405E-13 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 1 0 0.2412214E-18 1 0.1187011E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 2 0 0.1065994E-10 1 0.3145802E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 3 0 0.2198039E-18 1 0.2880265E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 4 0 0.3001632E-17 1 0.4714879E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 5 0 0.6537180E-09 1 0.3396777E-09 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 6 0 0.9916479E-17 1 0.3474172E-09 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 7 0 0.2435676E-16 1 0.2580513E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 8 0 0.3498245E-09 1 0.6767120E-10 2 0.0000000E+00 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9871992 average vibrational energy (ev) = 0.017488 average rotational energy (ev) = 0.470695 average diffraction energy (ev) = 0.050057 the reaction probability = 0.1280079D-01 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 184907.7198 (a) ... Propagating the wavefunction 181175.7967 (b) Setup time 3259.5242 Saving the wave function for rerun 134.7520 Calculating averages 9.0198 Calculating and saving BK-coeffs 31.4653 Asymptotic analysis 12.1071 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 184622.6651 (a) ... FFTs along X and Y 9884.7005 Kinetic energy operation along Z 46263.1309 Kinetic energy operation along r 35285.0750 Potential energy multiplication 21864.4464 Legengre transforms 55071.5266 Shifting the wavefunction 4239.6395 Kinetic energy multiplications (xy) 957.8389 Absorbing the wavefunction 1069.8511 Projection formalism 21.5622 Operations on specular grid 0.2104 ----------------------------------------------------- Sum 174657.9815 (b) ... Potential initialisation time 0.0000 Potential setup time 3170.5390 FFTs along X 5226.0091 FFTs along Y 4658.6914 Time spent on FGH for asympwf 0.6480 Ending date and time: Thu Aug 15 05:34:59 CEST 2019