Starting date and time: Tue Aug 13 23:19:08 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 231908.423 *** * 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: v0j8mj8-0.15eV-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: 8 * 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: 8 * 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 = 8 ... *** 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 = 0.91075897E-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 = 143 iz = 145 iz = 149 iz = 153 iz = 157 iz = 161 iz = 147 iz = 151 iz = 155 iz = 146 iz = 159 iz = 150 iz = 154 iz = 158 iz = 162 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 = 0.26217753E+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 = 393 ******************************************************************************** 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 = 22223 ******************************************************************************** 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 1.53576637 0.66633383E-01 0.12500000E+04 0.99999979 14.24395525 1.53576299 0.47394719E-01 0.13000000E+04 0.99999979 14.11763261 1.53576158 0.33589151E-01 0.13500000E+04 0.99999978 13.99129287 1.53575903 0.23771132E-01 0.14000000E+04 0.99999977 13.86493454 1.53575530 0.16830009E-01 0.14500000E+04 0.99999976 13.73855599 1.53575542 0.11939073E-01 0.15000000E+04 0.99999975 13.61215541 1.53576515 0.84968641E-02 0.15500000E+04 0.99999975 13.48573073 1.53577642 0.60728911E-02 0.16000000E+04 0.99999974 13.35927957 1.53577866 0.43625372E-02 0.16500000E+04 0.99999973 13.23279923 1.53578200 0.31518931E-02 0.17000000E+04 0.99999972 13.10628664 1.53578929 0.22914455E-02 0.17500000E+04 0.99999971 12.97973835 1.53579631 0.16769331E-02 0.18000000E+04 0.99999970 12.85315057 1.53580863 0.12356814E-02 0.18500000E+04 0.99999970 12.72651912 1.53583129 0.91698061E-03 0.19000000E+04 0.99999969 12.59983952 1.53585963 0.68536715E-03 0.19500000E+04 0.99999968 12.47310701 1.53588158 0.51596036E-03 0.20000000E+04 0.99999967 12.34631657 1.53590164 0.39123500E-03 0.20500000E+04 0.99999966 12.21946299 1.53592928 0.29879170E-03 0.21000000E+04 0.99999965 12.09254089 1.53595740 0.22981304E-03 0.21500000E+04 0.99999965 11.96554475 1.53598987 0.17799620E-03 0.22000000E+04 0.99999964 11.83846894 1.53603133 0.13881064E-03 0.22500000E+04 0.99999963 11.71130773 1.53607954 0.10898073E-03 0.23000000E+04 0.99999962 11.58405531 1.53612243 0.86124910E-04 0.23500000E+04 0.99999961 11.45670578 1.53615940 0.68500161E-04 0.24000000E+04 0.99999961 11.32925317 1.53620240 0.54823660E-04 0.24500000E+04 0.99999960 11.20169145 1.53624812 0.44145430E-04 0.25000000E+04 0.99999959 11.07401453 1.53629391 0.35757769E-04 0.25500000E+04 0.99999958 10.94621633 1.53634802 0.29130375E-04 0.26000000E+04 0.99999957 10.81829074 1.53640741 0.23863591E-04 0.26500000E+04 0.99999956 10.69023174 1.53646354 0.19654268E-04 0.27000000E+04 0.99999956 10.56203344 1.53651091 0.16272092E-04 0.27500000E+04 0.99999955 10.43369014 1.53656112 0.13539909E-04 0.28000000E+04 0.99999954 10.30519649 1.53661729 0.11321449E-04 0.28500000E+04 0.99999953 10.17654757 1.53667186 0.95111514E-05 0.29000000E+04 0.99999952 10.04773908 1.53673260 0.80268100E-05 0.29500000E+04 0.99999952 9.91876749 1.53680001 0.68038542E-05 0.30000000E+04 0.99999951 9.78963030 1.53686540 0.57921066E-05 0.30500000E+04 0.99999950 9.66032624 1.53692295 0.49512867E-05 0.31000000E+04 0.99999949 9.53085557 1.53698083 0.42495523E-05 0.31500000E+04 0.99999948 9.40122038 1.53704789 0.36614727E-05 0.32000000E+04 0.99999947 9.27142494 1.53711764 0.31666631E-05 0.32500000E+04 0.99999947 9.14147602 1.53719245 0.27487175E-05 0.33000000E+04 0.99999946 9.01138334 1.53728005 0.23943625E-05 0.33500000E+04 0.99999945 8.88115996 1.53737202 0.20928000E-05 0.34000000E+04 0.99999944 8.75082266 1.53746497 0.18352134E-05 0.34500000E+04 0.99999943 8.62039246 1.53756499 0.16143999E-05 0.35000000E+04 0.99999943 8.48989498 1.53768734 0.14244762E-05 0.35500000E+04 0.99999942 8.35936091 1.53783184 0.12603831E-05 0.36000000E+04 0.99999941 8.22882642 1.53799981 0.11186028E-05 0.36500000E+04 0.99999940 8.09833350 1.53820553 0.99553318E-06 0.37000000E+04 0.99999939 7.96793036 1.53845105 0.88835488E-06 0.37500000E+04 0.99999938 7.83767171 1.53873650 0.79471791E-06 0.38000000E+04 0.99999936 7.70761904 1.53907638 0.71268123E-06 0.38500000E+04 0.99999933 7.57784079 1.53949306 0.64063663E-06 0.39000000E+04 0.99999928 7.44841252 1.54000425 0.57723052E-06 0.39500000E+04 0.99999920 7.31941696 1.54061851 0.52110141E-06 0.40000000E+04 0.99999906 7.19094401 1.54136116 0.47167094E-06 0.40500000E+04 0.99999880 7.06309068 1.54225529 0.42786991E-06 0.41000000E+04 0.99999837 6.93596093 1.54331360 0.38895207E-06 0.41500000E+04 0.99999763 6.80966546 1.54456491 0.35426446E-06 0.42000000E+04 0.99999643 6.68432139 1.54604663 0.32324942E-06 0.42500000E+04 0.99999449 6.56005185 1.54779525 0.29545744E-06 0.43000000E+04 0.99999144 6.43698556 1.54983607 0.27054262E-06 0.43500000E+04 0.99998678 6.31525618 1.55220046 0.24803152E-06 0.44000000E+04 0.99997978 6.19500176 1.55492592 0.22805188E-06 0.44500000E+04 0.99996950 6.07636396 1.55803437 0.21011616E-06 0.45000000E+04 0.99995471 5.95948732 1.56154888 0.19393577E-06 0.45500000E+04 0.99993384 5.84451840 1.56550206 0.17925801E-06 0.46000000E+04 0.99990491 5.73160497 1.56991638 0.16589423E-06 0.46500000E+04 0.99986553 5.62089507 1.57480014 0.15371337E-06 0.47000000E+04 0.99981282 5.51253612 1.58014907 0.14261250E-06 0.47500000E+04 0.99974340 5.40667403 1.58595947 0.13249419E-06 0.48000000E+04 0.99965338 5.30345238 1.59220917 0.12326653E-06 0.48500000E+04 0.99953836 5.20301170 1.59885969 0.11485255E-06 0.49000000E+04 0.99939346 5.10548881 1.60587190 0.10718811E-06 0.49500000E+04 0.99921340 5.01101635 1.61319450 0.10000085E-06 0.50000000E+04 0.99899253 4.91972248 1.62075419 0.93633174E-07 0.50500000E+04 0.99872499 4.83173079 1.62845993 0.87793830E-07 0.51000000E+04 0.99840478 4.74716035 1.63621208 0.82404920E-07 0.51500000E+04 0.99802600 4.66612584 1.64390324 0.77407388E-07 0.52000000E+04 0.99758299 4.58873775 1.65141182 0.72763408E-07 0.52500000E+04 0.99707054 4.51510254 1.65861993 0.68448548E-07 0.53000000E+04 0.99648413 4.44532267 1.66541436 0.64441914E-07 0.53500000E+04 0.99582015 4.37949668 1.67167655 0.60721734E-07 0.54000000E+04 0.99507611 4.31771929 1.67728589 0.57266298E-07 0.54500000E+04 0.99425082 4.26008155 1.68212658 0.54058505E-07 0.55000000E+04 0.99334457 4.20667105 1.68609398 0.51084872E-07 0.55500000E+04 0.99235922 4.15757199 1.68909163 0.48146820E-07 0.56000000E+04 0.99129831 4.11286506 1.69104042 0.45610313E-07 0.56500000E+04 0.99016702 4.07262686 1.69189215 0.43260811E-07 0.57000000E+04 0.98897216 4.03692883 1.69163125 0.41083717E-07 0.57500000E+04 0.98772209 4.00583534 1.69028367 0.39048320E-07 0.58000000E+04 0.98642663 3.97940102 1.68792837 0.37123042E-07 0.58500000E+04 0.98509681 3.95766725 1.68469667 0.35320092E-07 0.59000000E+04 0.98374476 3.94065832 1.68075599 0.33628858E-07 0.59500000E+04 0.98238336 3.92837796 1.67628071 0.32030727E-07 0.60000000E+04 0.98102597 3.92080716 1.67142328 0.30528663E-07 0.60500000E+04 0.97968612 3.91790429 1.66627860 0.29075967E-07 0.61000000E+04 0.97837708 3.91960804 1.66086270 0.27711541E-07 0.61500000E+04 0.97711155 3.92584283 1.65512616 0.26511542E-07 0.62000000E+04 0.97590133 3.93652583 1.64899861 0.25187643E-07 0.62500000E+04 0.97475701 3.95157358 1.64245152 0.24032988E-07 0.63000000E+04 0.97368769 3.97090652 1.63555638 0.23016587E-07 0.63500000E+04 0.97270079 3.99444968 1.62851335 0.22037978E-07 0.64000000E+04 0.97180176 4.02212974 1.62162715 0.21007142E-07 0.64500000E+04 0.97099402 4.05386931 1.61522622 0.20124104E-07 0.65000000E+04 0.97027877 4.08958104 1.60955799 0.19380815E-07 0.65500000E+04 0.96965503 4.12916407 1.60469936 0.18537997E-07 0.66000000E+04 0.96911967 4.17250462 1.60052336 0.17673153E-07 0.66500000E+04 0.96866765 4.21948110 1.59674697 0.17085684E-07 0.67000000E+04 0.96829236 4.26997222 1.59304782 0.16747957E-07 0.67500000E+04 0.96798596 4.32386509 1.58920229 0.16043688E-07 0.68000000E+04 0.96773994 4.38106044 1.58517916 0.15100306E-07 0.68500000E+04 0.96754551 4.44147295 1.58114737 0.14672144E-07 0.69000000E+04 0.96739411 4.50502647 1.57739446 0.15128512E-07 0.69500000E+04 0.96727775 4.57164612 1.57419151 0.14918519E-07 0.70000000E+04 0.96718928 4.64125011 1.57166882 0.13372957E-07 0.70500000E+04 0.96712253 4.71374438 1.56975964 0.13242089E-07 0.71000000E+04 0.96707239 4.78902183 1.56823371 0.16208022E-07 0.71500000E+04 0.96703474 4.86696608 1.56679791 0.18543481E-07 ==> ZAnalysis on specular channel fixed at Z = 0.16700000E+02 0.72000000E+04 0.96700634 4.94745825 1.56521342 0.17929118E-07 0.72500000E+04 0.96698475 5.03038377 1.56337920 0.19930500E-07 0.73000000E+04 0.96696809 5.11563697 1.56134979 0.31006470E-07 0.73500000E+04 0.96695501 5.20312172 1.55929033 0.46477488E-07 0.74000000E+04 0.96694450 5.29274832 1.55739777 0.58387828E-07 0.74500000E+04 0.96693581 5.38442843 1.55582318 0.73845450E-07 0.75000000E+04 0.96692841 5.47807018 1.55462021 0.11067007E-06 0.75500000E+04 0.96692189 5.57357582 1.55373118 0.17192279E-06 0.76000000E+04 0.96691594 5.67084275 1.55301079 0.24212038E-06 0.76500000E+04 0.96691031 5.76976747 1.55227912 0.31908980E-06 0.77000000E+04 0.96690478 5.87025048 1.55138763 0.43361202E-06 0.77500000E+04 0.96689916 5.97220013 1.55027866 0.61883671E-06 0.78000000E+04 0.96689322 6.07553371 1.54901478 0.87047491E-06 0.78500000E+04 0.96688673 6.18017550 1.54775850 0.11627842E-05 0.79000000E+04 0.96687943 6.28605295 1.54670176 0.15064072E-05 0.79500000E+04 0.96687103 6.39309284 1.54597195 0.19654154E-05 0.80000000E+04 0.96686121 6.50121929 1.54556120 0.26022967E-05 0.80500000E+04 0.96684960 6.61035436 1.54532056 0.34232665E-05 0.81000000E+04 0.96683580 6.72042077 1.54503089 0.44024846E-05 0.81500000E+04 0.96681935 6.83134523 1.54451822 0.55616423E-05 0.82000000E+04 0.96679974 6.94306057 1.54375051 0.70076287E-05 0.82500000E+04 0.96677636 7.05550585 1.54285758 0.88854013E-05 0.83000000E+04 0.96674857 7.16862437 1.54205793 0.11308526E-04 0.83500000E+04 0.96671559 7.28236080 1.54153224 0.14357481E-04 0.84000000E+04 0.96667655 7.39665888 1.54131736 0.18162111E-04 0.84500000E+04 0.96663047 7.51146081 1.54128514 0.22997158E-04 0.85000000E+04 0.96657623 7.62670830 1.54122060 0.29311053E-04 0.85500000E+04 0.96651258 7.74234459 1.54095194 0.37674582E-04 0.86000000E+04 0.96643811 7.85831616 1.54045207 0.48714948E-04 0.86500000E+04 0.96635127 7.97457327 1.53984874 0.63125823E-04 0.87000000E+04 0.96625032 8.09106899 1.53933875 0.81786413E-04 0.87500000E+04 0.96613335 8.20775763 1.53906206 0.10591232E-03 0.88000000E+04 0.96599827 8.32459318 1.53901628 0.13710255E-03 0.88500000E+04 0.96584280 8.44152878 1.53906477 0.17722272E-03 0.89000000E+04 0.96566448 8.55851729 1.53903018 0.22822641E-03 0.89500000E+04 0.96546063 8.67551246 1.53880992 0.29210096E-03 0.90000000E+04 0.96522841 8.79247000 1.53843778 0.37101904E-03 0.90500000E+04 0.96496478 8.90934793 1.53805349 0.46755998E-03 0.91000000E+04 0.96466652 9.02610615 1.53780412 0.58475833E-03 0.91500000E+04 0.96433020 9.14270560 1.53774543 0.72587467E-03 0.92000000E+04 0.96395225 9.25910758 1.53780895 0.89403255E-03 0.92500000E+04 0.96352889 9.37527355 1.53785424 0.10919937E-02 0.93000000E+04 0.96305615 9.49116556 1.53776746 0.13222277E-02 0.93500000E+04 0.96252985 9.60674679 1.53753761 0.15871868E-02 0.94000000E+04 0.96194560 9.72198185 1.53725913 0.18895363E-02 0.94500000E+04 0.96129878 9.83683672 1.53706165 0.22321630E-02 0.95000000E+04 0.96058453 9.95127825 1.53701796 0.26179850E-02 0.95500000E+04 0.95979770 10.06527359 1.53709470 0.30497390E-02 0.96000000E+04 0.95893282 10.17878984 1.53717876 0.35299324E-02 0.96500000E+04 0.95798409 10.29179391 1.53715898 0.40609896E-02 0.97000000E+04 0.95694526 10.40425238 1.53700430 0.46454599E-02 0.97500000E+04 0.95580953 10.51613133 1.53678376 0.52860710E-02 0.98000000E+04 0.95456948 10.62739564 1.53661514 0.59854818E-02 0.98500000E+04 0.95321683 10.73800808 1.53658005 0.67457237E-02 0.99000000E+04 0.95174230 10.84792814 1.53666616 0.75674722E-02 0.99500000E+04 0.95013542 10.95711098 1.53677728 0.84493686E-02 0.10000000E+05 0.94838426 11.06550658 1.53680296 0.93875640E-02 0.10050000E+05 0.94647533 11.17305914 1.53669726 0.10375560E-01 0.10100000E+05 0.94439339 11.27970676 1.53651055 0.11404290E-01 0.10150000E+05 0.94212139 11.38538123 1.53635210 0.12462317E-01 0.10200000E+05 0.93964047 11.49000821 1.53631084 0.13536050E-01 0.10250000E+05 0.93693011 11.59350784 1.53639161 0.14609976E-01 0.10300000E+05 0.93396836 11.69579580 1.53651255 0.15667006E-01 0.10350000E+05 0.93073218 11.79678505 1.53656492 0.16689038E-01 0.10400000E+05 0.92719793 11.89638795 1.53649172 0.17657754E-01 0.10450000E+05 0.92334190 11.99451866 1.53632868 0.18555569E-01 0.10500000E+05 0.91914099 12.09109551 1.53617790 0.19366555E-01 0.10550000E+05 0.91457329 12.18604333 1.53613342 0.20077197E-01 0.10600000E+05 0.90961872 12.27929537 1.53621257 0.20676891E-01 0.10650000E+05 0.90425960 12.37079502 1.53634307 0.21158165E-01 0.10700000E+05 0.89848113 12.46049706 1.53641526 0.21516686E-01 0.10750000E+05 0.89227176 12.54836849 1.53636165 0.21751190E-01 0.10800000E+05 0.88562340 12.63438882 1.53620629 0.21863404E-01 0.10850000E+05 0.87853166 12.71855001 1.53604807 0.21857983E-01 0.10900000E+05 0.87099589 12.80085601 1.53598927 0.21742350E-01 0.10950000E+05 0.86301918 12.88132212 1.53606125 0.21526312E-01 0.11000000E+05 0.85460837 12.95997426 1.53620125 0.21221383E-01 0.11050000E+05 0.84577389 13.03684824 1.53629780 0.20839884E-01 0.11100000E+05 0.83652965 13.11198886 1.53627193 0.20393893E-01 0.11150000E+05 0.82689265 13.18544883 1.53613508 0.19894240E-01 0.11200000E+05 0.81688260 13.25728731 1.53598097 0.19349664E-01 0.11250000E+05 0.80652126 13.32756785 1.53591636 0.18766263E-01 0.11300000E+05 0.79583161 13.39635591 1.53598105 0.18147358E-01 0.11350000E+05 0.78483701 13.46371578 1.53611672 0.17493829E-01 0.11400000E+05 0.77356015 13.52970722 1.53620925 0.16804941E-01 0.11450000E+05 0.76202217 13.59438206 1.53617460 0.16079584E-01 0.11500000E+05 0.75024192 13.65778109 1.53602515 0.15317706E-01 0.11550000E+05 0.73823550 13.71993165 1.53586547 0.14521623E-01 0.11600000E+05 0.72601613 13.78084614 1.53581726 0.13696883E-01 0.11650000E+05 0.71359444 13.84052200 1.53592627 0.12852462E-01 0.11700000E+05 0.70097903 13.89894282 1.53612064 0.12000252E-01 0.11750000E+05 0.68817734 13.95608086 1.53625536 0.11154034E-01 0.11800000E+05 0.67519662 14.01190038 1.53621506 0.10328241E-01 0.11850000E+05 0.66204489 14.06636155 1.53600270 0.95368466E-02 0.11900000E+05 0.64873176 14.11942425 1.53574796 0.87925936E-02 0.11950000E+05 0.63526895 14.17105154 1.53562378 0.81066288E-02 0.12000000E+05 0.62167057 14.22121227 1.53572545 0.74884938E-02 0.12050000E+05 0.60795309 14.26988275 1.53599727 0.69463203E-02 0.12100000E+05 0.59413502 14.31704748 1.53626217 0.64870321E-02 0.12150000E+05 0.58023646 14.36269898 1.53633848 0.61163756E-02 0.12200000E+05 0.56627866 14.40683715 1.53616524 0.58386983E-02 0.12250000E+05 0.55228356 14.44946837 1.53584847 0.56565631E-02 0.12300000E+05 0.53827351 14.49060470 1.53559307 0.55704617E-02 0.12350000E+05 0.52427112 14.53026358 1.53556430 0.55789783E-02 0.12400000E+05 0.51029922 14.56846796 1.53577412 0.56796262E-02 0.12450000E+05 0.49638094 14.60524702 1.53607310 0.58702128E-02 0.12500000E+05 0.48253973 14.64063721 1.53625522 0.61501530E-02 0.12550000E+05 0.46879931 14.67468339 1.53620225 0.65209726E-02 0.12600000E+05 0.45518351 14.70743968 1.53596555 0.69854973E-02 0.12650000E+05 0.44171596 14.73896966 1.53572591 0.75458364E-02 0.12700000E+05 0.42841972 14.76934591 1.53565889 0.82009491E-02 0.12750000E+05 0.41531685 14.79864872 1.53580346 0.89449633E-02 0.12800000E+05 0.40242801 14.82696423 1.53603248 0.97672168E-02 0.12850000E+05 0.38977224 14.85438242 1.53615004 0.10654162E-01 0.12900000E+05 0.37736675 14.88099519 1.53604550 0.11592236E-01 0.12950000E+05 0.36522696 14.90689512 1.53578821 0.12570145E-01 0.13000000E+05 0.35336657 14.93217507 1.53558591 0.13579216E-01 0.13050000E+05 0.34179766 14.95692867 1.53562859 0.14611418E-01 0.13100000E+05 0.33053080 14.98125169 1.53593025 0.15656005E-01 0.13150000E+05 0.31957517 15.00524393 1.53629301 0.16696620E-01 0.13200000E+05 0.30893851 15.02901124 1.53643492 0.17710709E-01 0.13250000E+05 0.29862715 15.05266744 1.53619939 0.18671927E-01 0.13300000E+05 0.28864592 15.07633564 1.53569438 0.19554599E-01 0.13350000E+05 0.27899809 15.10014901 1.53524807 0.20338104E-01 0.13400000E+05 0.26968533 15.12425093 1.53519322 0.21008995E-01 0.13450000E+05 0.26070771 15.14879444 1.53562230 0.21559839E-01 0.13500000E+05 0.25206374 15.17394133 1.53629249 0.21985563E-01 0.13550000E+05 0.24375048 15.19986069 1.53676561 0.22279540E-01 0.13600000E+05 0.23576360 15.22672704 1.53670151 0.22431887E-01 0.13650000E+05 0.22809751 15.25471788 1.53610486 0.22431179E-01 0.13700000E+05 0.22074545 15.28401065 1.53534566 0.22268794E-01 0.13750000E+05 0.21369946 15.31477923 1.53492368 0.21943481E-01 0.13800000E+05 0.20695045 15.34719010 1.53512857 0.21463547E-01 0.13850000E+05 0.20048819 15.38139859 1.53583226 0.20845305E-01 0.13900000E+05 0.19430138 15.41754544 1.53656771 0.20108536E-01 0.13950000E+05 0.18837776 15.45575423 1.53684668 0.19271419E-01 0.14000000E+05 0.18270433 15.49612964 1.53649639 0.18347653E-01 0.14050000E+05 0.17726754 15.53875684 1.53577712 0.17347143E-01 0.14100000E+05 0.17205359 15.58370165 1.53519517 0.16279500E-01 0.14150000E+05 0.16704862 15.63101148 1.53514132 0.15158011E-01 0.14200000E+05 0.16223885 15.68071672 1.53561539 0.14001509E-01 0.14250000E+05 0.15761070 15.73283215 1.53623843 0.12832926E-01 0.14300000E+05 0.15315091 15.78735825 1.53654256 0.11675295E-01 0.14350000E+05 0.14884658 15.84428213 1.53632165 0.10547436E-01 0.14400000E+05 0.14468528 15.90357800 1.53578137 0.94616852E-02 0.14450000E+05 0.14065518 15.96520730 1.53537526 0.84246825E-02 0.14500000E+05 0.13674512 16.02911883 1.53544674 0.74404350E-02 0.14550000E+05 0.13294473 16.09524901 1.53594931 0.65136252E-02 0.14600000E+05 0.12924443 16.16352248 1.53646879 0.56511905E-02 0.14650000E+05 0.12563548 16.23385302 1.53654352 0.48614138E-02 0.14700000E+05 0.12210997 16.30614419 1.53604290 0.41513265E-02 0.14750000E+05 0.11866075 16.38028963 1.53530817 0.35241757E-02 0.14800000E+05 0.11528149 16.45617226 1.53492654 0.29785096E-02 0.14850000E+05 0.11196658 16.53366284 1.53528354 0.25093162E-02 0.14900000E+05 0.10871111 16.61261781 1.53622305 0.21103796E-02 0.14950000E+05 0.10551079 16.69287741 1.53709651 0.17763907E-02 0.15000000E+05 0.10236190 16.77426425 1.53720686 0.15036690E-02 0.15050000E+05 0.09926116 16.85658282 1.53634488 0.12893504E-02 0.15100000E+05 0.09620574 16.93961971 1.53501533 0.11298533E-02 0.15150000E+05 0.09319322 17.02314423 1.53414842 0.10197873E-02 0.15200000E+05 0.09022157 17.10690908 1.53445598 0.95204214E-03 0.15250000E+05 0.08728915 17.19065093 1.53587174 0.91894175E-03 0.15300000E+05 0.08439468 17.27409121 1.53750363 0.91366653E-03 0.15350000E+05 0.08153720 17.35693731 1.53819282 0.93104013E-03 0.15400000E+05 0.07871602 17.43888459 1.53733098 0.96727289E-03 0.15450000E+05 0.07593069 17.51961896 1.53536266 0.10189790E-02 0.15500000E+05 0.07318104 17.59881992 1.53357730 0.10822430E-02 0.15550000E+05 0.07046715 17.67616347 1.53327144 0.11524179E-02 0.15600000E+05 0.06778944 17.75132460 1.53481986 0.12247848E-02 0.15650000E+05 0.06514867 17.82397957 1.53731353 0.12955848E-02 0.15700000E+05 0.06254593 17.89380784 1.53908084 0.13626832E-02 0.15750000E+05 0.05998263 17.96049429 1.53880245 0.14253957E-02 0.15800000E+05 0.05746044 18.02373143 1.53647981 0.14835937E-02 0.15850000E+05 0.05498122 18.08322141 1.53355865 0.15367069E-02 0.15900000E+05 0.05254708 18.13867774 1.53204402 0.15833020E-02 0.15950000E+05 0.05016026 18.18982620 1.53313812 0.16215187E-02 0.16000000E+05 0.04782325 18.23640547 1.53631783 0.16500353E-02 0.16050000E+05 0.04553866 18.27816754 1.53954468 0.16688622E-02 0.16100000E+05 0.04330923 18.31487862 1.54056045 0.16793749E-02 0.16150000E+05 0.04113775 18.34632033 1.53845316 0.16835280E-02 0.16200000E+05 0.03902698 18.37229130 1.53442094 0.16827727E-02 0.16250000E+05 0.03697958 18.39260855 1.53112573 0.16774110E-02 0.16300000E+05 0.03499806 18.40710883 1.53095667 0.16668138E-02 0.16350000E+05 0.03308477 18.41565020 1.53432206 0.16503263E-02 0.16400000E+05 0.03124187 18.41811457 1.53917967 0.16281963E-02 0.16450000E+05 0.02947127 18.41441188 1.54225209 0.16018548E-02 0.16500000E+05 0.02777465 18.40448605 1.54122325 0.15733446E-02 0.16550000E+05 0.02615334 18.38832214 1.53646192 0.15443042E-02 0.16600000E+05 0.02460835 18.36595409 1.53101230 0.15152320E-02 0.16650000E+05 0.02314028 18.33747212 1.52868379 0.14855422E-02 0.16700000E+05 0.02174937 18.30303028 1.53140795 0.14543494E-02 0.16750000E+05 0.02043546 18.26285438 1.53768623 0.14213917E-02 0.16800000E+05 0.01919803 18.21725131 1.54335336 0.13874218E-02 0.16850000E+05 0.01803619 18.16661926 1.54432597 0.13538024E-02 0.16900000E+05 0.01694869 18.11145764 1.53954511 0.13216369E-02 0.16950000E+05 0.01593395 18.05237459 1.53200776 0.12910936E-02 0.17000000E+05 0.01499005 17.99009013 1.52694738 0.12614148E-02 0.17050000E+05 0.01411477 17.92543355 1.52821183 0.12315757E-02 0.17100000E+05 0.01330562 17.85933513 1.53533749 0.12010826E-02 0.17150000E+05 0.01255990 17.79281218 1.54355428 0.11703165E-02 0.17200000E+05 0.01187470 17.72694949 1.54697041 0.11401968E-02 0.17250000E+05 0.01124693 17.66287393 1.54282945 0.11114556E-02 0.17300000E+05 0.01067340 17.60172258 1.53375692 0.10840900E-02 0.17350000E+05 0.01015079 17.54460551 1.52615966 0.10573934E-02 0.17400000E+05 0.00967574 17.49256511 1.52569208 0.10305123E-02 0.17450000E+05 0.00924486 17.44653586 1.53300886 0.10030804E-02 0.17500000E+05 0.00885477 17.40730820 1.54303626 0.97545068E-03 0.17550000E+05 0.00850213 17.37549949 1.54850368 0.94837709E-03 0.17600000E+05 0.00818368 17.35153402 1.54526988 0.92242186E-03 0.17650000E+05 0.00789622 17.33563268 1.53550805 0.89755173E-03 0.17700000E+05 0.00763668 17.32781276 1.52627153 0.87321408E-03 0.17750000E+05 0.00740212 17.32789778 1.52436663 0.84880150E-03 0.17800000E+05 0.00718972 17.33553708 1.53129464 0.82412603E-03 0.17850000E+05 0.00699687 17.35023320 1.54206535 0.79954332E-03 0.17900000E+05 0.00682110 17.37137447 1.54882109 0.77565770E-03 0.17950000E+05 0.00666014 17.39826904 1.54660912 0.75286165E-03 0.18000000E+05 0.00651188 17.43017728 1.53703384 0.73106981E-03 0.18050000E+05 0.00637442 17.46634031 1.52708572 0.70983376E-03 0.18100000E+05 0.00624602 17.50600434 1.52400828 0.68871961E-03 0.18150000E+05 0.00612513 17.54844112 1.53000131 0.66764046E-03 0.18200000E+05 0.00601039 17.59296465 1.54065593 0.64689518E-03 0.18250000E+05 0.00590059 17.63894427 1.54822142 0.62690905E-03 0.18300000E+05 0.00579469 17.68581314 1.54725773 0.60789979E-03 0.18350000E+05 0.00569182 17.73307208 1.53854463 0.58972880E-03 0.18400000E+05 0.00559123 17.78028926 1.52844792 0.57203413E-03 0.18450000E+05 0.00549230 17.82709718 1.52425416 0.55451861E-03 0.18500000E+05 0.00539454 17.87318868 1.52890117 0.53716067E-03 0.18550000E+05 0.00529758 17.91831296 1.53892741 0.52019572E-03 0.18600000E+05 0.00520111 17.96227166 1.54705874 0.50390429E-03 0.18650000E+05 0.00510494 18.00491440 1.54748484 0.48838651E-03 0.18700000E+05 0.00500892 18.04613337 1.54000275 0.47349546E-03 0.18750000E+05 0.00491300 18.08585716 1.53008818 0.45896448E-03 0.18800000E+05 0.00481714 18.12404460 1.52489223 0.44461287E-03 0.18850000E+05 0.00472138 18.16067968 1.52807859 0.43046602E-03 0.18900000E+05 0.00462576 18.19576762 1.53723686 0.41670711E-03 0.18950000E+05 0.00453037 18.22933187 1.54569908 0.40351387E-03 0.19000000E+05 0.00443530 18.26141111 1.54738498 0.39091631E-03 0.19050000E+05 0.00434066 18.29205582 1.54116323 0.37878183E-03 0.19100000E+05 0.00424656 18.32132474 1.53161593 0.36692676E-03 0.19150000E+05 0.00415312 18.34928165 1.52568404 0.35525604E-03 0.19200000E+05 0.00406046 18.37599315 1.52762363 0.34382139E-03 0.19250000E+05 0.00396869 18.40152733 1.53593865 0.33276090E-03 0.19300000E+05 0.00387790 18.42595288 1.54451586 0.32217805E-03 0.19350000E+05 0.00378818 18.44933802 1.54710520 0.31205882E-03 0.19400000E+05 0.00369962 18.47174904 1.54186958 0.30228690E-03 0.19450000E+05 0.00361230 18.49324886 1.53270332 0.29273582E-03 0.19500000E+05 0.00352628 18.51389595 1.52636404 0.28335996E-03 0.19550000E+05 0.00344161 18.53374410 1.52749945 0.27421540E-03 0.19600000E+05 0.00335833 18.55284261 1.53522064 0.26540193E-03 0.19650000E+05 0.00327647 18.57123668 1.54377183 0.25697801E-03 0.19700000E+05 0.00319607 18.58896739 1.54680629 0.24891498E-03 0.19750000E+05 0.00311713 18.60607148 1.54209741 0.24112041E-03 0.19800000E+05 0.00303968 18.62258117 1.53319305 0.23350567E-03 0.19850000E+05 0.00296371 18.63852438 1.52677226 0.22604380E-03 0.19900000E+05 0.00288924 18.65392537 1.52764589 0.21877644E-03 0.19950000E+05 0.00281626 18.66880556 1.53513168 0.21177076E-03 0.20000000E+05 0.00274476 18.68318414 1.54355930 0.20506268E-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 -0.017952 0.69930 2 0.1554312 -0.020605 0.09769 3 0.1597487 -0.010785 -0.49025 4 0.1640662 0.003877 -1.08242 5 0.1683837 0.013758 -1.68515 6 0.1727013 0.013274 -2.28199 7 0.1770188 0.004087 -2.84339 8 0.1813363 -0.006600 2.92995 9 0.1856539 -0.011363 2.46603 10 0.1899714 -0.007640 2.03244 11 0.1942889 0.000997 1.61591 12 0.1986065 0.007987 1.21198 13 0.2029240 0.008707 0.82542 14 0.2072415 0.003448 0.46400 15 0.2115591 -0.003407 0.13049 16 0.2158766 -0.006920 -0.18015 17 0.2201941 -0.005046 -0.47768 18 0.2245117 0.000267 -0.77120 19 0.2288292 0.004790 -1.06411 20 0.2331467 0.005198 -1.35247 21 0.2374643 0.001528 -1.62985 22 0.2417818 -0.002901 -1.89589 23 0.2460993 -0.004297 -2.16090 24 0.2504169 -0.001732 -2.44349 25 0.2547344 0.002040 -2.76171 26 0.2590519 0.003350 -3.12166 27 0.2633695 0.001311 2.76080 28 0.2676870 -0.001501 2.29111 29 0.2720045 -0.002122 1.69153 30 0.2763221 -0.000443 1.04082 31 0.2806396 0.001160 0.54002 32 0.2849571 0.001016 0.17981 33 0.2892746 -0.000087 -0.12495 34 0.2935922 -0.000546 -0.41176 35 0.2979097 -0.000199 -0.67427 36 0.3022272 -0.000009 -0.90209 37 0.3065448 -0.000189 -1.10683 38 0.3108623 -0.000039 -1.31147 39 0.3151798 0.000458 -1.52689 40 0.3194974 0.000346 -1.74136 41 0.3238149 -0.000509 -1.93937 42 0.3281324 -0.000768 -2.12518 43 0.3324500 0.000262 -2.31622 44 0.3367675 0.001126 -2.51806 45 0.3410850 0.000334 -2.71480 46 0.3454026 -0.000985 -2.89277 47 0.3497201 -0.000596 -3.06083 48 0.3540376 0.001129 3.04787 49 0.3583552 0.001518 2.86905 50 0.3626727 -0.000059 2.70405 51 0.3669902 -0.000897 2.55752 52 0.3713078 0.000709 2.41348 53 0.3756253 0.002491 2.26041 54 0.3799428 0.001848 2.10976 55 0.3842604 0.000276 1.97673 56 0.3885779 0.001033 1.85403 57 0.3928954 0.003684 1.72341 58 0.3972129 0.004771 1.58530 59 0.4015305 0.003680 1.45892 60 0.4058480 0.003811 1.34853 61 0.4101655 0.006893 1.23574 62 0.4144831 0.010038 1.11070 63 0.4188006 0.010707 0.99066 64 0.4231181 0.011268 0.88985 65 0.4274357 0.015164 0.79372 66 0.4317532 0.021004 0.68452 67 0.4360707 0.024928 0.57395 68 0.4403883 0.027616 0.48325 69 0.4447058 0.033606 0.40364 70 0.4490233 0.043422 0.31206 71 0.4533409 0.052438 0.21343 72 0.4576584 0.059395 0.13339 73 0.4619759 0.069408 0.06943 74 0.4662935 0.084886 -0.00518 75 0.4706110 0.100620 -0.09215 76 0.4749285 0.113374 -0.16257 77 0.4792461 0.128602 -0.21289 78 0.4835636 0.150303 -0.27320 79 0.4878811 0.172597 -0.35178 80 0.4921987 0.190572 -0.41611 81 0.4965162 0.210130 -0.45703 82 0.5008337 0.236221 -0.50959 83 0.5051512 0.261922 -0.58794 84 0.5094688 0.281487 -0.65267 85 0.5137863 0.301931 -0.68988 86 0.5181038 0.328479 -0.74418 87 0.5224214 0.352995 -0.83410 88 0.5267389 0.370313 -0.90564 89 0.5310564 0.389012 -0.94364 90 0.5353740 0.413150 -1.00944 91 0.5396915 0.433231 -1.11776 92 0.5440090 0.446366 -1.18939 93 0.5483266 0.462557 -1.22030 ******************************************************************************** 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 0.9964308E+00 0.2277213E-01 0.4950134E+00 1 0.7653960E-06 0.1521219E-01 0.7573056E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.5093159E-07 0 31 2 -2 0.1123013E-07 0 37 2 -1 0.1606662E-07 0 44 2 0 0.5747856E-07 0 50 2 1 0.9794694E-07 0 56 2 2 0.4067837E-06 0 21 4 -4 0.5965285E-09 0 26 4 -3 0.8449189E-09 0 32 4 -2 0.3918703E-08 0 38 4 -1 0.9134947E-08 0 45 4 0 0.3590347E-07 0 51 4 1 0.9423973E-07 0 57 4 2 0.3193042E-06 0 62 4 3 0.6941787E-06 0 67 4 4 0.2103098E-05 0 13 6 -6 0.3821014E-10 0 17 6 -5 0.8853527E-10 0 22 6 -4 0.4638012E-10 0 27 6 -3 0.2298931E-09 0 33 6 -2 0.4938334E-09 0 39 6 -1 0.2180779E-08 0 46 6 0 0.8685042E-08 0 52 6 1 0.2983855E-07 0 58 6 2 0.2356980E-06 0 63 6 3 0.9372893E-06 0 68 6 4 0.3466413E-05 0 72 6 5 0.6432106E-05 0 76 6 6 0.2484943E-04 0 7 8 -8 0.1485994E-10 0 10 8 -7 0.8134130E-11 0 14 8 -6 0.6667979E-11 0 18 8 -5 0.2633665E-11 0 23 8 -4 0.1353394E-11 0 28 8 -3 0.3158652E-11 0 34 8 -2 0.2357716E-10 0 40 8 -1 0.8074977E-10 0 47 8 0 0.7820372E-09 0 53 8 1 0.3536540E-08 0 59 8 2 0.3666316E-07 0 64 8 3 0.1191975E-06 0 69 8 4 0.2482097E-05 0 73 8 5 0.6129579E-04 0 77 8 6 0.2418442E-02 0 80 8 7 0.5284565E-01 0 83 8 8 0.9410629E+00 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 0.2485068E-08 1 31 2 -2 0.1970378E-10 1 37 2 -1 0.5723974E-10 1 44 2 0 0.1043116E-08 1 50 2 1 0.1172364E-07 1 56 2 2 0.4993488E-06 1 21 4 -4 0.9732697E-12 1 26 4 -3 0.2762397E-12 1 32 4 -2 0.1125522E-12 1 38 4 -1 0.1821934E-11 1 45 4 0 0.3750928E-10 1 51 4 1 0.1614169E-08 1 57 4 2 0.1973362E-07 1 62 4 3 0.1903245E-07 1 67 4 4 0.2102975E-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 0.1857109E-15 1 0.1981474E-09 2 0.1428336E-08 3 0.2773625E-08 4 0.2068647E-08 5 0.5585884E-08 6 0.1039183E-07 7 0.1486437E-07 8 0.8889199E-08 9 0.4731554E-08 v, j, mj = 0 2 -2 0 0.1110019E-14 1 0.2597311E-09 2 0.4381425E-09 3 0.6227710E-09 4 0.4563501E-09 5 0.9126770E-09 6 0.1790092E-08 7 0.2208691E-08 8 0.2650172E-08 9 0.1891497E-08 v, j, mj = 0 2 -1 0 0.4749857E-10 1 0.1460993E-09 2 0.2966527E-09 3 0.3529033E-09 4 0.7230146E-09 5 0.5350979E-08 6 0.5174952E-08 7 0.2134072E-08 8 0.1285236E-08 9 0.5552159E-09 v, j, mj = 0 2 0 0 0.4446948E-15 1 0.7824697E-09 2 0.2086389E-08 3 0.1775071E-08 4 0.4205540E-08 5 0.8192213E-08 6 0.9746328E-08 7 0.1302733E-07 8 0.9883943E-08 9 0.7779284E-08 v, j, mj = 0 2 1 0 0.3023472E-15 1 0.1273593E-08 2 0.6721302E-08 3 0.5956270E-08 4 0.7618713E-08 5 0.3460695E-07 6 0.2351795E-07 7 0.9922549E-08 8 0.6377078E-08 9 0.1952532E-08 v, j, mj = 0 2 2 0 0.1445392E-07 1 0.3808861E-07 2 0.3171606E-07 3 0.3541974E-07 4 0.2147076E-07 5 0.3983888E-07 6 0.9268877E-07 7 0.8046970E-07 8 0.4482914E-07 9 0.7808143E-08 v, j, mj = 0 4 -4 0 0.2720810E-10 1 0.1968747E-10 2 0.5595496E-10 3 0.6320582E-10 4 0.9375690E-10 5 0.3156135E-10 6 0.3724748E-10 7 0.7506638E-10 8 0.1351909E-09 9 0.5764921E-10 v, j, mj = 0 4 -3 0 0.5240051E-15 1 0.7319816E-11 2 0.1635733E-10 3 0.3575713E-10 4 0.4791251E-10 5 0.7438220E-10 6 0.2211068E-09 7 0.1915385E-09 8 0.1468659E-09 9 0.1036783E-09 v, j, mj = 0 4 -2 0 0.4700518E-15 1 0.1095189E-10 2 0.6813203E-10 3 0.1772620E-09 4 0.6936793E-09 5 0.1057801E-08 6 0.4284103E-09 7 0.7182797E-09 8 0.5647303E-09 9 0.1994562E-09 v, j, mj = 0 4 -1 0 0.9368133E-11 1 0.2266127E-09 2 0.2575243E-09 3 0.6370092E-09 4 0.2003127E-08 5 0.1850290E-08 6 0.8028341E-09 7 0.1187304E-08 8 0.1276162E-08 9 0.8847150E-09 v, j, mj = 0 4 0 0 0.1617151E-15 1 0.7639318E-09 2 0.3262983E-08 3 0.3906412E-08 4 0.6966257E-08 5 0.6599062E-08 6 0.5850407E-08 7 0.4731590E-08 8 0.3035818E-08 9 0.7870098E-09 v, j, mj = 0 4 1 0 0.3508325E-15 1 0.1931440E-08 2 0.5265675E-08 3 0.2501081E-07 4 0.1570308E-07 5 0.1267527E-07 6 0.1361273E-07 7 0.9700228E-08 8 0.6523021E-08 9 0.3817480E-08 v, j, mj = 0 4 2 0 0.6660510E-08 1 0.1446460E-07 2 0.2850271E-07 3 0.6129914E-07 4 0.6134851E-07 5 0.6450081E-07 6 0.4493409E-07 7 0.2804359E-07 8 0.7810456E-08 9 0.1739839E-08 v, j, mj = 0 4 3 0 0.1745126E-14 1 0.2469013E-07 2 0.9908727E-07 3 0.9902250E-07 4 0.2184640E-06 5 0.9010615E-07 6 0.8906798E-07 7 0.5349371E-07 8 0.1684472E-07 9 0.3402302E-08 v, j, mj = 0 4 4 0 0.2104617E-13 1 0.6334095E-07 2 0.1351004E-06 3 0.1118592E-06 4 0.3865852E-06 5 0.4211323E-06 6 0.4381818E-06 7 0.5306442E-06 8 0.1049531E-07 9 0.5758612E-08 v, j, mj = 0 6 -6 0 0.6241400E-14 1 0.5065177E-12 2 0.1359334E-11 3 0.1733543E-11 4 0.6722426E-12 5 0.4553484E-11 6 0.1230046E-10 7 0.1635263E-10 8 0.7256977E-12 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2499635E-14 1 0.2906756E-12 2 0.1166516E-11 3 0.1144919E-11 4 0.1059602E-10 5 0.1591661E-10 6 0.2528190E-10 7 0.3301245E-10 8 0.1123678E-11 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.3133664E-12 1 0.3700021E-12 2 0.4141967E-12 3 0.1651391E-11 4 0.2408567E-11 5 0.6928325E-11 6 0.1221299E-10 7 0.2091126E-10 8 0.1170020E-11 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.1704028E-15 1 0.7883020E-12 2 0.2211874E-11 3 0.6309219E-11 4 0.1023939E-10 5 0.1701993E-10 6 0.5959322E-10 7 0.1231742E-09 8 0.1055682E-10 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.7041475E-16 1 0.1400982E-10 2 0.7537776E-11 3 0.3409312E-10 4 0.3521743E-10 5 0.2067894E-10 6 0.1563985E-09 7 0.2019647E-09 8 0.2393311E-10 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.4064375E-10 1 0.2753870E-10 2 0.1609911E-09 3 0.7848017E-10 4 0.1631716E-09 5 0.2526542E-09 6 0.4783442E-09 7 0.8131893E-09 8 0.1657655E-09 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.7656616E-16 1 0.3774719E-09 2 0.6824740E-09 3 0.1035523E-08 4 0.1008067E-08 5 0.4886268E-09 6 0.3343559E-08 7 0.1458563E-08 8 0.2907571E-09 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.2169529E-16 1 0.5052853E-08 2 0.8204074E-08 3 0.2152384E-08 4 0.1895461E-08 5 0.4164375E-08 6 0.4520481E-08 7 0.2811098E-08 8 0.1037818E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.2606003E-07 1 0.4100370E-07 2 0.3191427E-07 3 0.2411794E-07 4 0.4075161E-07 5 0.1141220E-07 6 0.4613451E-07 7 0.1329483E-07 8 0.1008865E-08 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.7623718E-15 1 0.2535387E-06 2 0.2365093E-06 3 0.1717441E-06 4 0.1499409E-06 5 0.7880165E-07 6 0.3557372E-07 7 0.1016990E-07 8 0.1010975E-08 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.1903214E-13 1 0.5230839E-06 2 0.6324951E-06 3 0.9612234E-06 4 0.8684818E-06 5 0.2264573E-06 6 0.1818608E-06 7 0.7243548E-07 8 0.3751087E-09 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.3406849E-07 1 0.1560760E-05 2 0.2095367E-05 3 0.1437693E-05 4 0.6425768E-06 5 0.4217785E-06 6 0.1642499E-06 7 0.7405821E-07 8 0.1553653E-08 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.7125991E-13 1 0.3023804E-05 2 0.4011459E-05 3 0.4609230E-05 4 0.6031728E-05 5 0.6901353E-05 6 0.1656542E-06 7 0.1047638E-06 8 0.1441719E-08 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1458736E-15 1 0.4256342E-12 2 0.2773858E-11 3 0.3374424E-11 4 0.5590505E-11 5 0.2695371E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6184609E-15 1 0.1037385E-14 2 0.3088032E-12 3 0.1313543E-11 4 0.2309209E-11 5 0.4200920E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2138636E-16 1 0.1019708E-13 2 0.1876054E-12 3 0.8443109E-12 4 0.3738314E-11 5 0.1887531E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.4147668E-17 1 0.1007162E-12 2 0.3717290E-12 3 0.4520380E-12 4 0.9954549E-12 5 0.7137230E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.2666256E-14 1 0.8257514E-13 2 0.2773778E-12 3 0.2241034E-12 4 0.2959441E-12 5 0.4707273E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2066876E-18 1 0.7545677E-13 2 0.5166337E-13 3 0.1568974E-12 4 0.1400318E-11 5 0.1474316E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3304420E-18 1 0.1505387E-12 2 0.1042178E-12 3 0.3927674E-12 4 0.1014554E-10 5 0.1278409E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.3065427E-12 1 0.2724888E-12 2 0.1043405E-11 3 0.2745770E-11 4 0.2293920E-10 5 0.5344237E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.7201653E-19 1 0.1152445E-10 2 0.1120449E-10 3 0.5154407E-11 4 0.3294594E-09 5 0.4246944E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.6502552E-19 1 0.1286788E-09 2 0.1232274E-09 3 0.4043883E-09 4 0.5492658E-09 5 0.2330979E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.2977735E-09 1 0.1701711E-08 2 0.2596825E-08 3 0.4892908E-08 4 0.1129930E-07 5 0.1587465E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1807021E-17 1 0.7946715E-08 2 0.1947656E-07 3 0.3378171E-07 4 0.2332872E-07 5 0.3466382E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.3778808E-16 1 0.2676312E-06 2 0.8871244E-06 3 0.9936379E-06 4 0.1652466E-06 5 0.1684567E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1270064E-06 1 0.2911640E-05 2 0.2656780E-04 3 0.3001645E-04 4 0.1602061E-05 5 0.7082852E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2986104E-15 1 0.2184484E-04 2 0.1540509E-02 3 0.8170387E-03 4 0.3898240E-04 5 0.6669584E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.3756066E-16 1 0.2895356E-02 2 0.3664079E-01 3 0.1293621E-01 4 0.3725538E-03 5 0.7410858E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.3198913E+00 1 0.1560584E-01 2 0.4948610E+00 3 0.1084226E+00 4 0.2280347E-02 5 0.1963346E-05 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.1702758E-15 1 0.5130225E-10 2 0.7024941E-10 3 0.2906654E-09 4 0.1606114E-08 5 0.4667369E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1514905E-16 1 0.1091705E-11 2 0.5851107E-11 3 0.5968265E-11 4 0.6792684E-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 2 -1 0 0.1489986E-11 1 0.1873151E-11 2 0.7484568E-11 3 0.3214010E-10 4 0.1425194E-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 2 0 0 0.6306042E-16 1 0.1014625E-09 2 0.1553648E-09 3 0.2280428E-09 4 0.5582454E-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 0.2199371E-17 1 0.7186793E-08 2 0.2748589E-08 3 0.1221886E-08 4 0.5663746E-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 2 0 0.1026895E-06 1 0.3037544E-06 2 0.5476668E-07 3 0.2060832E-07 4 0.1752994E-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 0.2098207E-12 1 0.4384297E-12 2 0.3250193E-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 0.3203286E-18 1 0.1019095E-13 2 0.2660484E-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 -2 0 0.3976484E-18 1 0.4021795E-13 2 0.7233381E-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 4 -1 0 0.3792635E-13 1 0.3402996E-12 2 0.1443708E-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 0 0 0.4350199E-18 1 0.4546470E-11 2 0.3296281E-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 0.3124204E-19 1 0.5842322E-09 2 0.1029937E-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 2 0 0.2312312E-08 1 0.1029655E-07 2 0.7124758E-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 0.3086155E-18 1 0.1491405E-07 2 0.4118402E-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 4 0 0.4580412E-17 1 0.1412449E-06 2 0.6905253E-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 = 0.9964316 average vibrational energy (ev) = 0.000000 average rotational energy (ev) = 0.495013 average diffraction energy (ev) = 0.022772 the reaction probability = 0.3568395D-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 0.9992846E+00 0.3131631E-01 0.4950084E+00 1 0.1424210E-05 0.2712807E-01 0.1139263E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.6689357E-07 0 31 2 -2 0.2208892E-07 0 37 2 -1 0.2171608E-07 0 44 2 0 0.6107101E-07 0 50 2 1 0.1434098E-06 0 56 2 2 0.5495953E-06 0 21 4 -4 0.3930524E-08 0 26 4 -3 0.2328872E-08 0 32 4 -2 0.5239439E-08 0 38 4 -1 0.1397092E-07 0 45 4 0 0.4841173E-07 0 51 4 1 0.1315402E-06 0 57 4 2 0.4665239E-06 0 62 4 3 0.1107332E-05 0 67 4 4 0.3319438E-05 0 13 6 -6 0.1141143E-09 0 17 6 -5 0.1109817E-09 0 22 6 -4 0.1253937E-09 0 27 6 -3 0.2985006E-09 0 33 6 -2 0.1305394E-08 0 39 6 -1 0.3371552E-08 0 46 6 0 0.1988402E-07 0 52 6 1 0.8540069E-07 0 58 6 2 0.3633721E-06 0 63 6 3 0.2130231E-05 0 68 6 4 0.4252845E-05 0 72 6 5 0.1538463E-04 0 76 6 6 0.3612164E-04 0 7 8 -8 0.2225924E-10 0 10 8 -7 0.2117621E-10 0 14 8 -6 0.2901932E-10 0 18 8 -5 0.6993334E-11 0 23 8 -4 0.5777046E-11 0 28 8 -3 0.1456428E-10 0 34 8 -2 0.7148970E-10 0 40 8 -1 0.2608618E-09 0 47 8 0 0.1652950E-08 0 53 8 1 0.8121639E-08 0 59 8 2 0.5255159E-07 0 64 8 3 0.3631910E-06 0 69 8 4 0.1034050E-04 0 73 8 5 0.3529505E-03 0 77 8 6 0.8093376E-02 0 80 8 7 0.8610028E-01 0 83 8 8 0.9046621E+00 0 3 10 -10 0.1546797E-12 0 5 10 -9 0.1686625E-12 0 8 10 -8 0.2471067E-13 0 11 10 -7 0.1087182E-13 0 15 10 -6 0.5997403E-14 0 19 10 -5 0.9072518E-14 0 24 10 -4 0.1251967E-13 0 29 10 -3 0.2454019E-13 0 35 10 -2 0.3036874E-14 0 41 10 -1 0.3470007E-13 0 48 10 0 0.1931018E-12 0 54 10 1 0.1039337E-11 0 60 10 2 0.1757381E-10 0 65 10 3 0.3509569E-10 0 70 10 4 0.2499151E-09 0 74 10 5 0.2461866E-09 0 78 10 6 0.9662675E-08 0 81 10 7 0.7793000E-08 0 84 10 8 0.4593784E-06 0 86 10 9 0.7092494E-07 0 88 10 10 0.2521579E-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 0.8486263E-08 1 31 2 -2 0.2758220E-09 1 37 2 -1 0.5418954E-09 1 44 2 0 0.5862724E-08 1 50 2 1 0.2810251E-07 1 56 2 2 0.3659244E-06 1 21 4 -4 0.2210887E-11 1 26 4 -3 0.3119568E-11 1 32 4 -2 0.5502240E-11 1 38 4 -1 0.4489875E-10 1 45 4 0 0.5549156E-09 1 51 4 1 0.6196399E-08 1 57 4 2 0.1125293E-07 1 62 4 3 0.2686262E-07 1 67 4 4 0.9700942E-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 0.1885777E-13 1 0.8474536E-09 2 0.1630757E-08 3 0.1768190E-08 4 0.3857507E-08 5 0.1150846E-07 6 0.2681462E-07 7 0.6580980E-08 8 0.1157830E-07 9 0.2307271E-08 v, j, mj = 0 2 -2 0 0.1885864E-13 1 0.1406418E-09 2 0.6583036E-09 3 0.2378929E-08 4 0.2593076E-08 5 0.3967822E-08 6 0.2941589E-08 7 0.5385021E-08 8 0.3119855E-08 9 0.9036674E-09 v, j, mj = 0 2 -1 0 0.2564056E-09 1 0.6430294E-09 2 0.9711173E-09 3 0.3005984E-08 4 0.3200900E-08 5 0.3019927E-08 6 0.4829375E-08 7 0.3252718E-08 8 0.1389499E-08 9 0.1147127E-08 v, j, mj = 0 2 0 0 0.1674192E-13 1 0.9738774E-09 2 0.1557502E-08 3 0.1236220E-08 4 0.5118975E-08 5 0.7637167E-08 6 0.1938415E-07 7 0.9418160E-08 8 0.1278483E-07 9 0.2960109E-08 v, j, mj = 0 2 1 0 0.4453037E-14 1 0.3003007E-08 2 0.1066461E-07 3 0.1106940E-07 4 0.1363271E-07 5 0.2255757E-07 6 0.4704555E-07 7 0.2465417E-07 8 0.7858455E-08 9 0.2924304E-08 v, j, mj = 0 2 2 0 0.3140049E-07 1 0.5219954E-07 2 0.3298191E-07 3 0.2063167E-07 4 0.3099869E-07 5 0.1128153E-06 6 0.1243511E-06 7 0.5771330E-07 8 0.7727264E-07 9 0.9230724E-08 v, j, mj = 0 4 -4 0 0.2118798E-09 1 0.2763995E-09 2 0.4846581E-09 3 0.6300672E-09 4 0.6142810E-09 5 0.6395512E-09 6 0.4173650E-09 7 0.2351896E-09 8 0.2304807E-09 9 0.1906514E-09 v, j, mj = 0 4 -3 0 0.6720841E-14 1 0.8036560E-10 2 0.1725957E-09 3 0.2603214E-09 4 0.3467012E-09 5 0.3556904E-09 6 0.5547827E-09 7 0.2286212E-09 8 0.1324330E-09 9 0.1973535E-09 v, j, mj = 0 4 -2 0 0.3061814E-14 1 0.1122774E-09 2 0.3192405E-09 3 0.3696340E-09 4 0.9275924E-09 5 0.6818339E-09 6 0.7579142E-09 7 0.6732984E-09 8 0.6372985E-09 9 0.7603469E-09 v, j, mj = 0 4 -1 0 0.1099328E-10 1 0.5680206E-09 2 0.1039610E-08 3 0.9238923E-09 4 0.3370894E-08 5 0.3503612E-08 6 0.1188953E-08 7 0.1160446E-08 8 0.1189246E-08 9 0.1015255E-08 v, j, mj = 0 4 0 0 0.7147025E-14 1 0.5118898E-08 2 0.5111011E-08 3 0.6997484E-08 4 0.7791697E-08 5 0.7560983E-08 6 0.3910600E-08 7 0.5286871E-08 8 0.3385230E-08 9 0.3248948E-08 v, j, mj = 0 4 1 0 0.4702144E-14 1 0.5780851E-08 2 0.1877193E-07 3 0.3141217E-07 4 0.2499022E-07 5 0.1578610E-07 6 0.1671046E-07 7 0.9921090E-08 8 0.4936049E-08 9 0.3231345E-08 v, j, mj = 0 4 2 0 0.1733689E-08 1 0.1022946E-06 2 0.3424365E-07 3 0.5125777E-07 4 0.1132238E-06 5 0.6483258E-07 6 0.4296978E-07 7 0.4190467E-07 8 0.7930817E-08 9 0.6132606E-08 v, j, mj = 0 4 3 0 0.2102199E-13 1 0.1928612E-07 2 0.6974450E-07 3 0.1666728E-06 4 0.3303449E-06 5 0.1863795E-06 6 0.2384531E-06 7 0.7984905E-07 8 0.1010567E-07 9 0.6495927E-08 v, j, mj = 0 4 4 0 0.3628787E-12 1 0.3903469E-07 2 0.4002128E-06 3 0.1158753E-06 4 0.6388676E-06 5 0.5714029E-06 6 0.8982840E-06 7 0.5839636E-06 8 0.6105682E-07 9 0.1073950E-07 v, j, mj = 0 6 -6 0 0.9859240E-13 1 0.2132824E-11 2 0.3537351E-11 3 0.1784907E-10 4 0.6525198E-11 5 0.1367461E-10 6 0.1876797E-10 7 0.3606047E-10 8 0.1546816E-10 9 0.0000000E+00 v, j, mj = 0 6 -5 0 0.2514467E-13 1 0.1563503E-11 2 0.3384043E-11 3 0.4448280E-11 4 0.4253586E-11 5 0.1872491E-10 6 0.1335504E-10 7 0.2816272E-10 8 0.3706449E-10 9 0.0000000E+00 v, j, mj = 0 6 -4 0 0.2887401E-11 1 0.3270154E-11 2 0.2803750E-11 3 0.5294698E-11 4 0.8420705E-11 5 0.1031949E-10 6 0.1441946E-10 7 0.3783929E-10 8 0.4013872E-10 9 0.0000000E+00 v, j, mj = 0 6 -3 0 0.1354627E-14 1 0.6626485E-11 2 0.2219528E-10 3 0.2436455E-10 4 0.2487002E-10 5 0.4084365E-10 6 0.3796865E-10 7 0.5288170E-10 8 0.8874891E-10 9 0.0000000E+00 v, j, mj = 0 6 -2 0 0.5920306E-15 1 0.3300752E-10 2 0.7718876E-10 3 0.9701769E-10 4 0.1021671E-09 5 0.5167348E-10 6 0.1982083E-09 7 0.2737620E-09 8 0.4723682E-09 9 0.0000000E+00 v, j, mj = 0 6 -1 0 0.1120018E-09 1 0.3024652E-09 2 0.3119977E-09 3 0.3593852E-09 4 0.3948014E-09 5 0.4241916E-09 6 0.5279207E-09 7 0.2964306E-09 8 0.6423575E-09 9 0.0000000E+00 v, j, mj = 0 6 0 0 0.2590521E-14 1 0.2987562E-08 2 0.3569173E-08 3 0.2252417E-08 4 0.1713420E-08 5 0.1545740E-08 6 0.1673563E-08 7 0.2330887E-08 8 0.3811255E-08 9 0.0000000E+00 v, j, mj = 0 6 1 0 0.6037311E-15 1 0.2376507E-07 2 0.1937242E-07 3 0.1505225E-07 4 0.5885140E-08 5 0.5643406E-08 6 0.8558518E-08 7 0.3739023E-08 8 0.3384866E-08 9 0.0000000E+00 v, j, mj = 0 6 2 0 0.7975270E-07 1 0.4578666E-07 2 0.6918674E-07 3 0.6074498E-07 4 0.4983787E-07 5 0.1726479E-07 6 0.1528038E-07 7 0.1168542E-07 8 0.1383255E-07 9 0.0000000E+00 v, j, mj = 0 6 3 0 0.8701318E-14 1 0.6608452E-06 2 0.3511707E-06 3 0.5717179E-06 4 0.3459113E-06 5 0.6255809E-07 6 0.8876380E-07 7 0.3407185E-07 8 0.1519194E-07 9 0.0000000E+00 v, j, mj = 0 6 4 0 0.2197533E-12 1 0.4394924E-06 2 0.1229482E-05 3 0.1207922E-05 4 0.1025219E-05 5 0.1702011E-06 6 0.1125246E-06 7 0.4842745E-07 8 0.1957607E-07 9 0.0000000E+00 v, j, mj = 0 6 5 0 0.5778566E-07 1 0.3073001E-05 2 0.3510324E-05 3 0.4438259E-05 4 0.2331263E-05 5 0.1413327E-05 6 0.4391146E-06 7 0.9716322E-07 8 0.2439628E-07 9 0.0000000E+00 v, j, mj = 0 6 6 0 0.1584933E-11 1 0.6661086E-05 2 0.1560779E-05 3 0.3949519E-05 4 0.8991560E-05 5 0.1228575E-04 6 0.2414451E-05 7 0.1967584E-06 8 0.6173487E-07 9 0.0000000E+00 v, j, mj = 0 8 -8 0 0.1914371E-13 1 0.1147409E-11 2 0.4110474E-11 3 0.3278529E-11 4 0.4263683E-11 5 0.5168583E-11 6 0.4271423E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1339599E-13 1 0.1209941E-12 2 0.1091751E-11 3 0.2353330E-11 4 0.3375029E-11 5 0.6298176E-11 6 0.7923531E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.2634641E-14 1 0.1605207E-12 2 0.6329388E-12 3 0.9748288E-12 4 0.5295973E-11 5 0.1291819E-10 6 0.9034234E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.5349742E-15 1 0.4584615E-13 2 0.1632932E-12 3 0.2379344E-12 4 0.1014505E-11 5 0.4080202E-11 6 0.1451019E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1156435E-12 1 0.1622622E-12 2 0.8301591E-13 3 0.1778341E-12 4 0.5434176E-12 5 0.2571221E-11 6 0.2123652E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2152819E-16 1 0.2810835E-13 2 0.2785188E-12 3 0.3703918E-12 4 0.7780436E-12 5 0.6075387E-11 6 0.7033814E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.3293880E-17 1 0.6051888E-12 2 0.1763901E-12 3 0.6609115E-12 4 0.3472938E-11 5 0.1526756E-10 6 0.5130671E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.2421806E-11 1 0.3076902E-11 2 0.4894990E-11 3 0.4031023E-11 4 0.1012395E-10 5 0.1325696E-09 6 0.1037435E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.1283685E-16 1 0.6005284E-10 2 0.3792739E-10 3 0.7568795E-10 4 0.1080788E-09 5 0.2023231E-09 6 0.1168879E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2507598E-17 1 0.2916270E-09 2 0.4779727E-09 3 0.1398674E-08 4 0.5284608E-09 5 0.3428962E-08 6 0.1995942E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.1631463E-10 1 0.5238975E-08 2 0.5912136E-08 3 0.7754150E-08 4 0.1124830E-07 5 0.4930300E-08 6 0.1745142E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.6929426E-16 1 0.3655560E-07 2 0.2346518E-07 3 0.1567131E-06 4 0.8232696E-07 5 0.3921948E-07 6 0.2491071E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.2935292E-14 1 0.2285942E-06 2 0.1425025E-05 3 0.7020580E-05 4 0.1463097E-05 5 0.1169652E-06 6 0.8623572E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.1148545E-06 1 0.3916052E-05 2 0.8863242E-04 3 0.2219410E-03 4 0.3754324E-04 5 0.7343882E-06 6 0.6856231E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.3736509E-13 1 0.9253660E-04 2 0.2991407E-02 3 0.4416539E-02 4 0.5866648E-03 5 0.6139237E-05 6 0.8929797E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.5742764E-14 1 0.3522268E-03 2 0.3338805E-01 3 0.4664825E-01 4 0.5649193E-02 5 0.6247118E-04 6 0.9622481E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.2503870E-01 1 0.5067011E+00 2 0.6623195E-01 3 0.2763940E+00 4 0.3002837E-01 5 0.2669931E-03 6 0.1064013E-05 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.3106223E-13 1 0.1232137E-12 2 0.4037521E-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 0.5715880E-18 1 0.1621395E-12 2 0.6522399E-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 -8 0 0.3060530E-18 1 0.1999211E-13 2 0.4718251E-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 -7 0 0.8437356E-16 1 0.1076869E-13 2 0.1876138E-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 -6 0 0.1267169E-17 1 0.5907397E-14 2 0.8873840E-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 0.1115936E-18 1 0.8837624E-14 2 0.2347830E-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 0.4604204E-14 1 0.7801096E-14 2 0.1143720E-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 -3 0 0.7393304E-19 1 0.2437620E-13 2 0.1639096E-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 -2 0 0.3617126E-19 1 0.2943865E-14 2 0.9297273E-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 -1 0 0.1176188E-14 1 0.3276936E-13 2 0.7545165E-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 0 0 0.6949102E-19 1 0.1872298E-12 2 0.5871969E-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 1 0 0.1695206E-19 1 0.9714420E-12 2 0.6789460E-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 2 0 0.8551296E-11 1 0.8786203E-11 2 0.2363157E-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 3 0 0.1736286E-19 1 0.3093393E-10 2 0.4161758E-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 4 0 0.1020331E-18 1 0.2326240E-09 2 0.1729110E-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 5 0 0.2538650E-10 1 0.1724468E-09 2 0.4835327E-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 6 0 0.8394784E-18 1 0.9609097E-08 2 0.5357770E-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 7 0 0.7561246E-18 1 0.7745651E-08 2 0.4734862E-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 8 0 0.3332815E-06 1 0.1246502E-06 2 0.1446623E-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 9 0 0.9543153E-19 1 0.6616252E-07 2 0.4762421E-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 10 0 0.4372195E-18 1 0.2513192E-06 2 0.8387640E-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 0 0 0 0.1398354E-13 1 0.2249619E-08 2 0.2932403E-08 3 0.6732524E-09 4 0.1119289E-08 5 0.1384228E-08 6 0.1274583E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.7218039E-14 1 0.2852794E-10 2 0.3487209E-10 3 0.1732114E-10 4 0.6413400E-10 5 0.1309596E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.4533518E-10 1 0.1052109E-09 2 0.1610793E-09 3 0.4039748E-10 4 0.9155245E-10 5 0.9832001E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1098717E-13 1 0.1096832E-08 2 0.5875409E-09 3 0.4843580E-09 4 0.7199016E-09 5 0.2974080E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2935755E-15 1 0.2150019E-07 2 0.1049717E-08 3 0.1704588E-08 4 0.1380052E-08 5 0.2467957E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1414451E-06 1 0.4204653E-07 2 0.6965856E-07 3 0.3199555E-07 4 0.4147938E-07 5 0.3929926E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1179909E-12 1 0.1623526E-12 2 0.3798047E-12 3 0.1341163E-11 4 0.2095764E-12 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 0.7487537E-18 1 0.4720082E-12 2 0.2689202E-12 3 0.1765580E-11 4 0.6130592E-12 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 0.7966341E-16 1 0.3879174E-12 2 0.1032156E-11 3 0.1825554E-11 4 0.2256533E-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 -1 0 0.8875579E-12 1 0.2241890E-11 2 0.2373123E-11 3 0.3349175E-10 4 0.5904432E-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 0 0 0.1905974E-15 1 0.1305681E-10 2 0.1592768E-09 3 0.3284273E-09 4 0.5415454E-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 0.1107986E-16 1 0.5697409E-09 2 0.2828631E-08 3 0.2429391E-08 4 0.3686366E-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 0.2094463E-08 1 0.4265564E-08 2 0.1303906E-08 3 0.2055396E-08 4 0.1533601E-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 0.1186181E-17 1 0.4184837E-08 2 0.8838408E-08 3 0.1252819E-07 4 0.1311183E-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 0.3702486E-16 1 0.6646476E-06 2 0.1199519E-06 3 0.1769694E-06 4 0.8525294E-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 = 0.9992861 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.495008 average diffraction energy (ev) = 0.031316 the reaction probability = 0.7139398D-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 0.1000035E+01 0.4147130E-01 0.4949641E+00 1 0.1573606E-05 0.4279092E-01 0.1100063E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.1843491E-06 0 31 2 -2 0.5777949E-07 0 37 2 -1 0.3117019E-07 0 44 2 0 0.9471036E-07 0 50 2 1 0.3169738E-06 0 56 2 2 0.1164225E-05 0 21 4 -4 0.1734878E-07 0 26 4 -3 0.4081215E-08 0 32 4 -2 0.9780870E-08 0 38 4 -1 0.2983423E-07 0 45 4 0 0.1073877E-06 0 51 4 1 0.3430719E-06 0 57 4 2 0.1009369E-05 0 62 4 3 0.3003770E-05 0 67 4 4 0.7046814E-05 0 13 6 -6 0.4846117E-09 0 17 6 -5 0.3089456E-09 0 22 6 -4 0.2735111E-09 0 27 6 -3 0.8027498E-09 0 33 6 -2 0.2245699E-08 0 39 6 -1 0.1212734E-07 0 46 6 0 0.7214733E-07 0 52 6 1 0.4627174E-06 0 58 6 2 0.1757829E-05 0 63 6 3 0.6629988E-05 0 68 6 4 0.1968116E-04 0 72 6 5 0.5268919E-04 0 76 6 6 0.1929049E-03 0 7 8 -8 0.3415586E-10 0 10 8 -7 0.3926585E-10 0 14 8 -6 0.3702654E-10 0 18 8 -5 0.2984776E-10 0 23 8 -4 0.2061468E-10 0 28 8 -3 0.2903748E-10 0 34 8 -2 0.1323175E-09 0 40 8 -1 0.4644158E-09 0 47 8 0 0.3587537E-08 0 53 8 1 0.1150766E-07 0 59 8 2 0.1220772E-06 0 64 8 3 0.2964797E-05 0 69 8 4 0.9262081E-04 0 73 8 5 0.2005297E-02 0 77 8 6 0.2434047E-01 0 80 8 7 0.1636801E+00 0 83 8 8 0.8096187E+00 0 3 10 -10 0.2062796E-11 0 5 10 -9 0.4209830E-11 0 8 10 -8 0.2068178E-11 0 11 10 -7 0.1519284E-11 0 15 10 -6 0.1914763E-12 0 19 10 -5 0.1842232E-12 0 24 10 -4 0.5710176E-12 0 29 10 -3 0.3955641E-12 0 35 10 -2 0.5317737E-12 0 41 10 -1 0.2806066E-11 0 48 10 0 0.2260986E-10 0 54 10 1 0.1535824E-09 0 60 10 2 0.8567750E-09 0 65 10 3 0.3598131E-08 0 70 10 4 0.1222107E-07 0 74 10 5 0.4218895E-07 0 78 10 6 0.2943323E-06 0 81 10 7 0.2709766E-06 0 84 10 8 0.9169266E-06 0 86 10 9 0.2413951E-05 0 88 10 10 0.3108571E-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 0.1099489E-07 1 31 2 -2 0.1563668E-08 1 37 2 -1 0.1531033E-08 1 44 2 0 0.1185433E-07 1 50 2 1 0.9331973E-07 1 56 2 2 0.4620646E-06 1 21 4 -4 0.1843348E-10 1 26 4 -3 0.1466259E-10 1 32 4 -2 0.5879241E-10 1 38 4 -1 0.1165935E-09 1 45 4 0 0.1064964E-08 1 51 4 1 0.5343391E-08 1 57 4 2 0.4204814E-07 1 62 4 3 0.1307658E-06 1 67 4 4 0.7684690E-06 1 13 6 -6 0.2192122E-13 1 17 6 -5 0.3558696E-13 1 22 6 -4 0.6993419E-13 1 27 6 -3 0.1606480E-13 1 33 6 -2 0.2969157E-13 1 39 6 -1 0.2123935E-12 1 46 6 0 0.3731639E-11 1 52 6 1 0.1750438E-10 1 58 6 2 0.1248165E-09 1 63 6 3 0.2975245E-09 1 68 6 4 0.2193372E-08 1 72 6 5 0.5231909E-08 1 76 6 6 0.3650912E-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 0.1357690E-12 1 0.8360505E-08 2 0.1640194E-07 3 0.1838136E-07 4 0.3148294E-07 5 0.5785975E-07 6 0.2206297E-07 7 0.1918239E-07 8 0.8696554E-08 9 0.1920530E-08 v, j, mj = 0 2 -2 0 0.1250420E-12 1 0.8240800E-08 2 0.9410741E-08 3 0.1241136E-07 4 0.5271398E-08 5 0.7020689E-08 6 0.7722722E-08 7 0.4324920E-08 8 0.2105332E-08 9 0.1271403E-08 v, j, mj = 0 2 -1 0 0.4149689E-09 1 0.3222081E-08 2 0.9439044E-09 3 0.3896591E-08 4 0.6718763E-08 5 0.4889406E-08 6 0.5627392E-08 7 0.3491089E-08 8 0.1167216E-08 9 0.7987752E-09 v, j, mj = 0 2 0 0 0.7348147E-13 1 0.6080865E-08 2 0.1017858E-07 3 0.1406045E-07 4 0.1577451E-07 5 0.1542837E-07 6 0.1142570E-07 7 0.1084580E-07 8 0.7558256E-08 9 0.3357774E-08 v, j, mj = 0 2 1 0 0.2293722E-13 1 0.7809573E-08 2 0.2762202E-07 3 0.1834167E-07 4 0.5288792E-07 5 0.1112345E-06 6 0.3639598E-07 7 0.4449603E-07 8 0.1482904E-07 9 0.3357030E-08 v, j, mj = 0 2 2 0 0.5845544E-07 1 0.2234956E-07 2 0.3593680E-07 3 0.1310727E-06 4 0.1983260E-06 5 0.1937392E-06 6 0.3616912E-06 7 0.7763858E-07 8 0.7916715E-07 9 0.5848115E-08 v, j, mj = 0 4 -4 0 0.2149792E-08 1 0.1800989E-08 2 0.4076526E-08 3 0.1838713E-08 4 0.2599480E-08 5 0.2732082E-08 6 0.1029143E-08 7 0.6101279E-09 8 0.2563818E-09 9 0.2555469E-09 v, j, mj = 0 4 -3 0 0.2564005E-13 1 0.2098179E-09 2 0.2890142E-09 3 0.1029565E-08 4 0.7760756E-09 5 0.4996487E-09 6 0.4552611E-09 7 0.2492423E-09 8 0.3285425E-09 9 0.2440222E-09 v, j, mj = 0 4 -2 0 0.1751754E-13 1 0.1126620E-08 2 0.1565920E-08 3 0.1856845E-08 4 0.1241445E-08 5 0.6042431E-09 6 0.9219171E-09 7 0.4798933E-09 8 0.9449643E-09 9 0.1039006E-08 v, j, mj = 0 4 -1 0 0.3516082E-10 1 0.3843137E-08 2 0.7075909E-08 3 0.2261149E-08 4 0.6107388E-08 5 0.4241185E-08 6 0.2698887E-08 7 0.1106217E-08 8 0.1006823E-08 9 0.1458379E-08 v, j, mj = 0 4 0 0 0.2779667E-13 1 0.1201846E-07 2 0.2937978E-07 3 0.2485951E-07 4 0.1498184E-07 5 0.7907267E-08 6 0.6308273E-08 7 0.4336666E-08 8 0.4187784E-08 9 0.3408084E-08 v, j, mj = 0 4 1 0 0.2450531E-13 1 0.3330547E-07 2 0.2093933E-07 3 0.1680807E-06 4 0.5797444E-07 5 0.2381561E-07 6 0.2143667E-07 7 0.7553328E-08 8 0.5221392E-08 9 0.4744996E-08 v, j, mj = 0 4 2 0 0.2490233E-07 1 0.5698855E-07 2 0.1962794E-06 3 0.2317818E-06 4 0.1706503E-06 5 0.1991310E-06 6 0.8255498E-07 7 0.3428670E-07 8 0.9039549E-08 9 0.3754677E-08 v, j, mj = 0 4 3 0 0.8381887E-13 1 0.2119069E-06 2 0.1145582E-06 3 0.4323174E-06 4 0.9159966E-06 5 0.4603534E-06 6 0.7439488E-06 7 0.7419214E-07 8 0.4164422E-07 9 0.8852521E-08 v, j, mj = 0 4 4 0 0.2082726E-11 1 0.6021792E-06 2 0.5955539E-06 3 0.4551253E-06 4 0.1022906E-05 5 0.2979160E-05 6 0.5416358E-06 7 0.7714449E-06 8 0.6228450E-07 9 0.1652222E-07 v, j, mj = 0 6 -6 0 0.4020650E-12 1 0.8922939E-10 2 0.7222351E-10 3 0.7300547E-10 4 0.7707949E-10 5 0.2010732E-10 6 0.7268550E-10 7 0.4737195E-10 8 0.3023498E-10 9 0.2272064E-11 v, j, mj = 0 6 -5 0 0.1332103E-12 1 0.4513247E-11 2 0.1940754E-10 3 0.2915417E-10 4 0.6750750E-10 5 0.3200520E-10 6 0.3297219E-10 7 0.5208136E-10 8 0.6287459E-10 9 0.8296610E-11 v, j, mj = 0 6 -4 0 0.4307609E-10 1 0.7348567E-11 2 0.3048756E-10 3 0.5522563E-10 4 0.1218039E-10 5 0.1707062E-10 6 0.1460901E-10 7 0.3290973E-10 8 0.4957609E-10 9 0.1102737E-10 v, j, mj = 0 6 -3 0 0.9811649E-14 1 0.4926630E-10 2 0.1053258E-09 3 0.6589898E-10 4 0.2601745E-10 5 0.7475795E-10 6 0.5973296E-10 7 0.1454933E-09 8 0.2626297E-09 9 0.1361744E-10 v, j, mj = 0 6 -2 0 0.7788263E-14 1 0.3262902E-09 2 0.4723571E-09 3 0.3462373E-09 4 0.3178683E-09 5 0.8513843E-10 6 0.1345705E-09 7 0.2091302E-09 8 0.3004718E-09 9 0.5362706E-10 v, j, mj = 0 6 -1 0 0.3054234E-09 1 0.1951033E-08 2 0.3940233E-08 3 0.9254958E-09 4 0.5755260E-09 5 0.5143808E-09 6 0.5118264E-09 7 0.8456819E-09 8 0.2498426E-08 9 0.5931701E-10 v, j, mj = 0 6 0 0 0.2826086E-13 1 0.3122963E-07 2 0.2004990E-07 3 0.8321527E-08 4 0.4718359E-08 5 0.2970907E-08 6 0.1298345E-08 7 0.1507817E-08 8 0.1623922E-08 9 0.4268923E-09 v, j, mj = 0 6 1 0 0.9576569E-14 1 0.2383062E-06 2 0.8207619E-07 3 0.5415731E-07 4 0.5037832E-07 5 0.1233626E-07 6 0.6758857E-08 7 0.4530858E-08 8 0.1380920E-07 9 0.3641443E-09 v, j, mj = 0 6 2 0 0.4556662E-06 1 0.1715241E-06 2 0.2392304E-06 3 0.4537318E-06 4 0.3430817E-06 5 0.4513754E-07 6 0.2576845E-07 7 0.1283734E-07 8 0.9486825E-08 9 0.1364389E-08 v, j, mj = 0 6 3 0 0.8739388E-13 1 0.1007034E-05 2 0.1204404E-05 3 0.2716420E-05 4 0.1299572E-05 5 0.2703895E-06 6 0.8148945E-07 7 0.1487551E-07 8 0.3424141E-07 9 0.1562062E-08 v, j, mj = 0 6 4 0 0.2067377E-11 1 0.1047582E-06 2 0.3161452E-05 3 0.7768890E-05 4 0.6029288E-05 5 0.2093448E-05 6 0.4109160E-06 7 0.5333298E-07 8 0.5643177E-07 9 0.2642662E-08 v, j, mj = 0 6 5 0 0.1039001E-06 1 0.8125655E-05 2 0.3017653E-05 3 0.8011789E-05 4 0.1914019E-04 5 0.1109459E-04 6 0.2940441E-05 7 0.1569219E-06 8 0.9557699E-07 9 0.2469410E-08 v, j, mj = 0 6 6 0 0.1024621E-10 1 0.3368523E-04 2 0.8467706E-05 3 0.4336075E-04 4 0.4577624E-04 5 0.5166422E-04 6 0.9388752E-05 7 0.4341322E-06 8 0.1246581E-06 9 0.3198433E-08 v, j, mj = 0 8 -8 0 0.1329680E-12 1 0.3102954E-11 2 0.8553200E-11 3 0.4419921E-11 4 0.3552768E-11 5 0.5079148E-11 6 0.8087607E-11 7 0.1227291E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1614278E-12 1 0.7259602E-12 2 0.1330507E-11 3 0.2308534E-11 4 0.8153887E-11 5 0.9247301E-11 6 0.1385335E-10 7 0.3484887E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.3782203E-13 1 0.4354100E-12 2 0.1000594E-11 3 0.6534066E-12 4 0.1957345E-11 5 0.1654868E-10 6 0.1363389E-10 7 0.2759385E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.1382212E-13 1 0.1222721E-12 2 0.2258713E-12 3 0.5064043E-12 4 0.1112899E-11 5 0.5588714E-11 6 0.2181372E-10 7 0.4640616E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.1881966E-12 1 0.2005780E-12 2 0.4717661E-12 3 0.1213275E-11 4 0.2126222E-11 5 0.5121854E-11 6 0.8844370E-11 7 0.2448423E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.4370943E-15 1 0.2742474E-12 2 0.7000936E-12 3 0.5751233E-12 4 0.2001284E-11 5 0.7922219E-11 6 0.1321543E-10 7 0.4348647E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1502559E-15 1 0.6153590E-11 2 0.1538100E-11 3 0.4519545E-11 4 0.3296016E-11 5 0.2306521E-10 6 0.7311373E-10 7 0.2063120E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1244770E-10 1 0.8424972E-11 2 0.9749055E-11 3 0.3747508E-10 4 0.3846367E-10 5 0.1280442E-09 6 0.1631034E-09 7 0.6670773E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.3211416E-15 1 0.1476648E-09 2 0.7746654E-10 3 0.1085780E-09 4 0.2836153E-09 5 0.5846640E-09 6 0.2178876E-08 7 0.2066726E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.1495616E-15 1 0.3681709E-09 2 0.8763660E-09 3 0.1237095E-08 4 0.2605993E-08 5 0.2595159E-08 6 0.3364090E-08 7 0.4607842E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.6219938E-08 1 0.7083651E-09 2 0.9036404E-08 3 0.2796209E-07 4 0.4670116E-07 5 0.7280825E-08 6 0.2260320E-07 7 0.1565244E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1975159E-14 1 0.8649098E-07 2 0.2233879E-06 3 0.1593151E-05 4 0.9561038E-06 5 0.7433875E-07 6 0.2889394E-07 7 0.2430614E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.9786757E-13 1 0.9657374E-06 2 0.1225686E-04 3 0.5505828E-04 4 0.2290856E-04 5 0.1332224E-05 6 0.9182441E-07 7 0.7326402E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3188986E-07 1 0.1647985E-04 2 0.3637102E-03 3 0.1189571E-02 4 0.4183608E-03 5 0.1691838E-04 6 0.2168348E-06 7 0.8497895E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.6287911E-12 1 0.1614671E-03 2 0.4324683E-02 3 0.1504054E-01 4 0.4631607E-02 5 0.1815125E-03 6 0.6563710E-06 7 0.4673085E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.5054548E-13 1 0.1909335E-01 2 0.1940122E-01 3 0.9389015E-01 4 0.3013085E-01 5 0.1160286E-02 6 0.4184467E-05 7 0.1039643E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.9035721E-01 1 0.2155516E+00 2 0.2474208E+00 3 0.1468169E+00 4 0.1053595E+00 5 0.4098766E-02 6 0.1396169E-04 7 0.9624736E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1895111E-12 1 0.1055151E-11 2 0.5003359E-12 3 0.3177985E-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 -9 0 0.1480145E-17 1 0.8096213E-12 2 0.2923840E-11 3 0.4763671E-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 0.1051983E-17 1 0.3763726E-12 2 0.1420740E-11 3 0.2710644E-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 0.1329266E-15 1 0.6139404E-13 2 0.9054916E-12 3 0.5522656E-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 0.3809363E-17 1 0.2099406E-14 2 0.5738966E-13 3 0.1319835E-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 0.2747291E-18 1 0.6645170E-13 2 0.7774585E-13 3 0.4002533E-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 -4 0 0.2478711E-13 1 0.1883184E-12 2 0.3200124E-12 3 0.3789976E-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 -3 0 0.1187803E-18 1 0.8867771E-13 2 0.1078484E-12 3 0.1990379E-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 -2 0 0.6925520E-18 1 0.1040228E-13 2 0.1439536E-12 3 0.3774172E-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 -1 0 0.1773103E-13 1 0.2265185E-13 2 0.1255672E-11 3 0.1510011E-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 = 0 10 0 0 0.1924894E-18 1 0.4232610E-12 2 0.1449080E-10 3 0.7695797E-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 = 0 10 1 0 0.2280363E-19 1 0.7764447E-11 2 0.1101541E-09 3 0.3566392E-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 2 0 0.5898939E-11 1 0.6405950E-10 2 0.6908647E-09 3 0.9595183E-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 0.9004016E-19 1 0.9873718E-10 2 0.2035673E-08 3 0.1463721E-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 4 0 0.3443006E-18 1 0.1614364E-08 2 0.4201050E-08 3 0.6405656E-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 5 0 0.8868160E-09 1 0.5011556E-08 2 0.2299309E-07 3 0.1329749E-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 0.6937663E-17 1 0.1362459E-07 2 0.5728052E-07 3 0.2234272E-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 0.4464845E-17 1 0.1807602E-07 2 0.2216114E-06 3 0.3128916E-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 8 0 0.2106293E-06 1 0.4924292E-06 2 0.1507095E-06 3 0.6315859E-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 0.1073209E-17 1 0.1891678E-06 2 0.1751489E-05 3 0.4732944E-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 10 0 0.9564188E-18 1 0.1209003E-05 2 0.1311007E-05 3 0.5885616E-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 = 1 0 0 0 0.8488772E-13 1 0.1159291E-08 2 0.4497366E-08 3 0.1901749E-08 4 0.1191965E-08 5 0.5739137E-09 6 0.1662242E-08 7 0.8282579E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.5457972E-13 1 0.2613282E-09 2 0.2243902E-09 3 0.3936058E-09 4 0.2375713E-09 5 0.1680882E-09 6 0.2786299E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.2025533E-10 1 0.2596327E-09 2 0.5815271E-09 3 0.1938995E-09 4 0.1902699E-09 5 0.1476805E-09 6 0.1377683E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1205341E-12 1 0.1891489E-08 2 0.5624185E-08 3 0.1401560E-08 4 0.8801699E-09 5 0.1429045E-08 6 0.6277623E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.5818432E-15 1 0.2158443E-07 2 0.5795890E-07 3 0.7896211E-08 4 0.2510876E-08 5 0.1978996E-08 6 0.1390314E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.2367567E-07 1 0.2306383E-06 2 0.1167821E-06 3 0.2817732E-07 4 0.3315496E-07 5 0.2348576E-07 6 0.6150440E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2757302E-11 1 0.5306949E-11 2 0.1916640E-11 3 0.2299888E-11 4 0.4885869E-11 5 0.1266836E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.1015066E-15 1 0.2402544E-12 2 0.1464006E-11 3 0.5796090E-11 4 0.6677878E-11 5 0.4842588E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1014610E-14 1 0.2150871E-11 2 0.9602526E-12 3 0.9117832E-11 4 0.4479900E-10 5 0.1763436E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.4043406E-11 1 0.8960645E-11 2 0.2612201E-10 3 0.6452370E-11 4 0.6276444E-10 5 0.8250645E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7043075E-14 1 0.2180076E-09 2 0.2002624E-09 3 0.2311991E-09 4 0.3400125E-09 5 0.7547578E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.3684094E-16 1 0.9090810E-09 2 0.9609655E-09 3 0.2075988E-08 4 0.1059246E-08 5 0.3381101E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.5822987E-08 1 0.1464459E-07 2 0.9383678E-08 3 0.4742052E-08 4 0.6548985E-08 5 0.9058518E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.8889160E-15 1 0.3923265E-07 2 0.2500631E-07 3 0.4783770E-07 4 0.1795791E-07 5 0.7312634E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1051474E-12 1 0.9242503E-07 2 0.2656573E-06 3 0.3092131E-06 4 0.9956327E-07 5 0.1610222E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.3225056E-17 1 0.2069303E-13 2 0.1224966E-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 0.2235985E-18 1 0.2145987E-13 2 0.1412687E-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 0.6035262E-13 1 0.5332836E-15 2 0.9048287E-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 -3 0 0.6338512E-19 1 0.1167892E-13 2 0.4385816E-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 -2 0 0.6947390E-18 1 0.2471822E-13 2 0.4972654E-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 -1 0 0.1139855E-13 1 0.1100683E-12 2 0.9092663E-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 0 0 0.8462777E-18 1 0.3396048E-11 2 0.3355894E-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 6 1 0 0.3581607E-18 1 0.1719019E-10 2 0.3141816E-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 6 2 0 0.1813002E-10 1 0.1000950E-09 2 0.6591430E-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 6 3 0 0.5771086E-18 1 0.2892216E-09 2 0.8302938E-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 6 4 0 0.2375004E-17 1 0.2051042E-08 2 0.1423300E-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 5 0 0.3357955E-08 1 0.1436259E-08 2 0.4376962E-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 0.1668363E-16 1 0.3614875E-07 2 0.3603702E-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 = 1.0000365 average vibrational energy (ev) = 0.000001 average rotational energy (ev) = 0.494963 average diffraction energy (ev) = 0.041471 the reaction probability = -0.3651536D-04 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.40129667D+01 trans energy = 0.37857143D+00 trans energy in z = 0.37857143D+00 total momentum = 0.10111041D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9979439E+00 0.4995160E-01 0.4946732E+00 1 0.3938932E-05 0.4790275E-01 0.1385827E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.3937904E-05 0 31 2 -2 0.2214171E-05 0 37 2 -1 0.1069377E-05 0 44 2 0 0.1600810E-05 0 50 2 1 0.5625241E-05 0 56 2 2 0.1200466E-04 0 21 4 -4 0.1131404E-05 0 26 4 -3 0.2241708E-06 0 32 4 -2 0.1017784E-06 0 38 4 -1 0.3071067E-06 0 45 4 0 0.7039067E-06 0 51 4 1 0.1914768E-05 0 57 4 2 0.8263717E-05 0 62 4 3 0.2226773E-04 0 67 4 4 0.4157114E-04 0 13 6 -6 0.1145062E-06 0 17 6 -5 0.4300171E-07 0 22 6 -4 0.2267706E-07 0 27 6 -3 0.6510226E-08 0 33 6 -2 0.1268586E-07 0 39 6 -1 0.6866479E-07 0 46 6 0 0.4331627E-06 0 52 6 1 0.2218678E-05 0 58 6 2 0.1008141E-04 0 63 6 3 0.4054779E-04 0 68 6 4 0.1318991E-03 0 72 6 5 0.3116401E-03 0 76 6 6 0.1060614E-02 0 7 8 -8 0.2352372E-09 0 10 8 -7 0.1851364E-09 0 14 8 -6 0.9136954E-10 0 18 8 -5 0.4886373E-10 0 23 8 -4 0.7171227E-10 0 28 8 -3 0.1449392E-09 0 34 8 -2 0.2981246E-09 0 40 8 -1 0.2072962E-08 0 47 8 0 0.9214988E-08 0 53 8 1 0.6211976E-07 0 59 8 2 0.1471977E-05 0 64 8 3 0.4372086E-04 0 69 8 4 0.8599733E-03 0 73 8 5 0.9833938E-02 0 77 8 6 0.5843926E-01 0 80 8 7 0.2497904E+00 0 83 8 8 0.6773043E+00 0 3 10 -10 0.6027215E-11 0 5 10 -9 0.8926969E-11 0 8 10 -8 0.6940446E-11 0 11 10 -7 0.7624234E-11 0 15 10 -6 0.2449907E-11 0 19 10 -5 0.1822762E-11 0 24 10 -4 0.1073222E-11 0 29 10 -3 0.3746491E-11 0 35 10 -2 0.1056748E-10 0 41 10 -1 0.3580794E-10 0 48 10 0 0.1580180E-09 0 54 10 1 0.5653549E-09 0 60 10 2 0.1780341E-08 0 65 10 3 0.1333479E-07 0 70 10 4 0.3425389E-07 0 74 10 5 0.1274774E-06 0 78 10 6 0.3593877E-06 0 81 10 7 0.4975399E-06 0 84 10 8 0.2547662E-05 0 86 10 9 0.2293257E-05 0 88 10 10 0.4207473E-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 0.1901871E-07 1 31 2 -2 0.5125950E-08 1 37 2 -1 0.2320243E-08 1 44 2 0 0.2145204E-07 1 50 2 1 0.6339398E-07 1 56 2 2 0.6489320E-06 1 21 4 -4 0.1454256E-09 1 26 4 -3 0.8553156E-10 1 32 4 -2 0.2477343E-09 1 38 4 -1 0.5837591E-09 1 45 4 0 0.4365043E-08 1 51 4 1 0.1322319E-07 1 57 4 2 0.2147334E-06 1 62 4 3 0.9433956E-06 1 67 4 4 0.1607955E-05 1 13 6 -6 0.7727042E-12 1 17 6 -5 0.6604459E-12 1 22 6 -4 0.8829995E-12 1 27 6 -3 0.1736303E-11 1 33 6 -2 0.3738309E-11 1 39 6 -1 0.1544368E-10 1 46 6 0 0.1884789E-09 1 52 6 1 0.3691962E-09 1 58 6 2 0.2749614E-08 1 63 6 3 0.3174847E-08 1 68 6 4 0.3119407E-07 1 72 6 5 0.1156430E-06 1 76 6 6 0.2406118E-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 0.4709307E-12 1 0.1455188E-06 2 0.1235173E-06 3 0.3062350E-06 4 0.1227367E-05 5 0.1385968E-05 6 0.4422317E-06 7 0.2287569E-06 8 0.7341065E-07 9 0.4898232E-08 v, j, mj = 0 2 -2 0 0.3273792E-12 1 0.2899650E-06 2 0.2774886E-06 3 0.3070652E-06 4 0.5143919E-06 5 0.4952312E-06 6 0.2529493E-06 7 0.6434887E-07 8 0.1104657E-07 9 0.1683785E-08 v, j, mj = 0 2 -1 0 0.2561335E-09 1 0.5418271E-07 2 0.9473701E-07 3 0.3417869E-06 4 0.3239833E-06 5 0.1740380E-06 6 0.5826611E-07 7 0.1972504E-07 8 0.1698582E-08 9 0.7031331E-09 v, j, mj = 0 2 0 0 0.4095078E-12 1 0.3469697E-06 2 0.3712727E-06 3 0.3063948E-06 4 0.1288776E-06 5 0.2379716E-06 6 0.1002552E-06 7 0.7881437E-07 8 0.2595058E-07 9 0.4302941E-08 v, j, mj = 0 2 1 0 0.8658579E-13 1 0.3336707E-07 2 0.5641666E-06 3 0.9138866E-06 4 0.1647519E-05 5 0.1779066E-05 6 0.5434499E-06 7 0.1280825E-06 8 0.1411456E-07 9 0.1587996E-08 v, j, mj = 0 2 2 0 0.3297230E-06 1 0.3808308E-06 2 0.1047328E-05 3 0.1005402E-05 4 0.2325049E-05 5 0.2707414E-05 6 0.3120078E-05 7 0.8102354E-06 8 0.2657191E-06 9 0.1288161E-07 v, j, mj = 0 4 -4 0 0.1127897E-06 1 0.7404430E-07 2 0.1730410E-06 3 0.2090033E-06 4 0.2674694E-06 5 0.1983808E-06 6 0.7943813E-07 7 0.1630649E-07 8 0.5800366E-09 9 0.3511938E-09 v, j, mj = 0 4 -3 0 0.7900216E-13 1 0.1047015E-07 2 0.4596948E-07 3 0.7459242E-07 4 0.6420079E-07 5 0.2319506E-07 6 0.3982267E-08 7 0.1050191E-08 8 0.4007453E-09 9 0.3096685E-09 v, j, mj = 0 4 -2 0 0.9447806E-14 1 0.1704745E-08 2 0.1296848E-07 3 0.3796437E-07 4 0.2497978E-07 5 0.1267743E-07 6 0.8538712E-08 7 0.1691219E-08 8 0.6211541E-09 9 0.6325409E-09 v, j, mj = 0 4 -1 0 0.4542861E-09 1 0.5700877E-07 2 0.4167141E-07 3 0.9917239E-07 4 0.8026689E-07 5 0.1507239E-07 6 0.6427133E-08 7 0.3875074E-08 8 0.1072104E-08 9 0.2086275E-08 v, j, mj = 0 4 0 0 0.1081799E-12 1 0.9154720E-07 2 0.1205706E-06 3 0.3926996E-06 4 0.7042636E-07 5 0.1089430E-07 6 0.8918090E-08 7 0.4289497E-08 8 0.2922240E-08 9 0.1638588E-08 v, j, mj = 0 4 1 0 0.4348239E-13 1 0.1489389E-06 2 0.2913415E-06 3 0.1138726E-05 4 0.1204910E-06 5 0.1187514E-06 6 0.6267381E-07 7 0.2436767E-07 8 0.4551044E-08 9 0.4926630E-08 v, j, mj = 0 4 2 0 0.3012806E-06 1 0.4401017E-07 2 0.2811604E-05 3 0.1896647E-05 4 0.1743364E-05 5 0.1124758E-05 6 0.2823097E-06 7 0.4585385E-07 8 0.7542869E-08 9 0.6346458E-08 v, j, mj = 0 4 3 0 0.1871907E-12 1 0.1817179E-06 2 0.7666935E-06 3 0.4717073E-05 4 0.5466147E-05 5 0.5933508E-05 6 0.4395691E-05 7 0.7646104E-06 8 0.3214549E-07 9 0.1014802E-07 v, j, mj = 0 4 4 0 0.8547796E-11 1 0.4060529E-05 2 0.7488649E-05 3 0.3065107E-05 4 0.3330220E-05 5 0.1179940E-04 6 0.7939429E-05 7 0.3646569E-05 8 0.2314288E-06 9 0.9798396E-08 v, j, mj = 0 6 -6 0 0.1485043E-11 1 0.1061746E-07 2 0.1109347E-07 3 0.2722028E-07 4 0.3617521E-07 5 0.2412109E-07 6 0.4763848E-08 7 0.4084403E-09 8 0.6492295E-10 9 0.4001628E-10 v, j, mj = 0 6 -5 0 0.4365615E-12 1 0.7766487E-09 2 0.5116539E-08 3 0.1311475E-07 4 0.1430983E-07 5 0.8203894E-08 6 0.1280915E-08 7 0.7473166E-10 8 0.6239775E-10 9 0.6157063E-10 v, j, mj = 0 6 -4 0 0.1970123E-08 1 0.3223323E-08 2 0.6806411E-08 3 0.5781103E-08 4 0.3711694E-08 5 0.9116371E-09 6 0.1116309E-09 7 0.3523001E-10 8 0.7966814E-10 9 0.4623783E-10 v, j, mj = 0 6 -3 0 0.2426665E-13 1 0.1767522E-08 2 0.1979593E-08 3 0.1492959E-08 4 0.4356849E-09 5 0.2716478E-09 6 0.9295363E-10 7 0.8374400E-10 8 0.1825548E-09 9 0.2035434E-09 v, j, mj = 0 6 -2 0 0.1774785E-13 1 0.2296442E-08 2 0.2879957E-08 3 0.3934231E-08 4 0.1778316E-08 5 0.4486135E-09 6 0.2221860E-09 7 0.2937866E-09 8 0.4606070E-09 9 0.3717051E-09 v, j, mj = 0 6 -1 0 0.3734204E-09 1 0.1460116E-07 2 0.3978717E-07 3 0.5335109E-08 4 0.3708324E-08 5 0.1420452E-08 6 0.6767690E-09 7 0.6373699E-09 8 0.8837624E-09 9 0.1241252E-08 v, j, mj = 0 6 0 0 0.2441279E-12 1 0.2054498E-06 2 0.1226387E-06 3 0.5318858E-07 4 0.3327517E-07 5 0.9688055E-08 6 0.3172431E-08 7 0.1573265E-08 8 0.2377086E-08 9 0.1799431E-08 v, j, mj = 0 6 1 0 0.8274044E-13 1 0.1123767E-05 2 0.2395606E-06 3 0.5021260E-06 4 0.2897954E-06 5 0.3919110E-07 6 0.1090098E-07 7 0.5143556E-08 8 0.4998970E-08 9 0.3194548E-08 v, j, mj = 0 6 2 0 0.1654931E-05 1 0.4905568E-06 2 0.1352199E-05 3 0.4711093E-05 4 0.1595424E-05 5 0.2275637E-06 6 0.2495559E-07 7 0.6422671E-08 8 0.1469372E-07 9 0.3569079E-08 v, j, mj = 0 6 3 0 0.4468403E-12 1 0.1116705E-06 2 0.1160391E-04 3 0.1720620E-04 4 0.8347710E-05 5 0.2667518E-05 6 0.5076542E-06 7 0.5442222E-07 8 0.3887574E-07 9 0.9831282E-08 v, j, mj = 0 6 4 0 0.8447984E-11 1 0.8798190E-06 2 0.1768892E-04 3 0.3771153E-04 4 0.4624356E-04 5 0.2431290E-04 6 0.4719048E-05 7 0.2468031E-06 8 0.7234077E-07 9 0.2419458E-07 v, j, mj = 0 6 5 0 0.1068937E-06 1 0.2767259E-04 2 0.1856002E-04 3 0.2089146E-04 4 0.1258347E-03 5 0.9701661E-04 6 0.2038130E-04 7 0.1034696E-05 8 0.1262220E-06 9 0.1564246E-07 v, j, mj = 0 6 6 0 0.6706305E-10 1 0.1374321E-03 2 0.5980203E-04 3 0.3334247E-03 4 0.1819557E-03 5 0.2880213E-03 6 0.5716511E-04 7 0.2618676E-05 8 0.1846908E-06 9 0.9592511E-08 v, j, mj = 0 8 -8 0 0.5759769E-12 1 0.8240080E-11 2 0.2725502E-10 3 0.1191964E-09 4 0.4709169E-10 5 0.9814016E-11 6 0.9128004E-11 7 0.1393597E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6234400E-12 1 0.4774699E-11 2 0.3174536E-10 3 0.6580226E-10 4 0.3341892E-10 5 0.1210318E-10 6 0.1426076E-10 7 0.2240778E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1243835E-12 1 0.9095699E-11 2 0.2140786E-10 3 0.9010197E-11 4 0.7435962E-11 5 0.5514385E-11 6 0.2188310E-10 7 0.1689796E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.8062943E-13 1 0.3589136E-11 2 0.5506307E-11 3 0.4009487E-11 4 0.3004525E-11 5 0.5640604E-11 6 0.1199733E-10 7 0.1503570E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.8766050E-11 1 0.4613464E-12 2 0.3548754E-11 3 0.2489132E-11 4 0.2153845E-11 5 0.6968382E-11 6 0.2205716E-10 7 0.2526761E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.3004275E-14 1 0.6299300E-11 2 0.1209900E-11 3 0.4305317E-11 4 0.2255421E-11 5 0.1715245E-10 6 0.6041321E-10 7 0.5330064E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1597987E-14 1 0.2911997E-10 2 0.3624080E-10 3 0.1099439E-10 4 0.1370168E-10 5 0.2482142E-10 6 0.9518076E-10 7 0.8806396E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1970439E-10 1 0.1468584E-09 2 0.2938456E-09 3 0.1431285E-09 4 0.1375711E-09 5 0.2026373E-09 6 0.5504890E-09 7 0.5787276E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.4926177E-14 1 0.2877119E-08 2 0.1159837E-08 3 0.5475045E-09 4 0.1124883E-08 5 0.7165838E-09 6 0.8342994E-09 7 0.1954756E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.2418381E-14 1 0.1336483E-07 2 0.5221064E-08 3 0.7234393E-08 4 0.2192130E-07 5 0.3716122E-08 6 0.4680213E-08 7 0.5981828E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.5311744E-07 1 0.1237061E-07 2 0.8984310E-07 3 0.6615936E-06 4 0.5885124E-06 5 0.4096299E-07 6 0.9114745E-08 7 0.1646184E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2374836E-13 1 0.4247142E-06 2 0.4956149E-05 3 0.2400300E-04 4 0.1307166E-04 5 0.1192107E-05 6 0.4857357E-07 7 0.2465123E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.1040075E-11 1 0.5550058E-05 2 0.1500922E-03 3 0.4663497E-03 4 0.2187899E-03 5 0.1883910E-04 6 0.2968579E-06 7 0.5555216E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.5365286E-07 1 0.6431605E-04 2 0.1982976E-02 3 0.5177495E-02 4 0.2399542E-02 5 0.2066002E-03 6 0.2870543E-05 7 0.8564666E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.5173129E-11 1 0.5881654E-04 2 0.7798365E-02 3 0.3148460E-01 4 0.1751577E-01 5 0.1560878E-02 6 0.2076110E-04 7 0.6698448E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1658026E-12 1 0.2962306E-01 2 0.2982565E-01 3 0.1057985E+00 4 0.7718083E-01 5 0.7277376E-02 6 0.8496276E-04 7 0.8170644E-07 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1155827E+00 1 0.7136954E-01 2 0.3317518E+00 3 0.2358496E-01 4 0.1166862E+00 5 0.1810825E-01 6 0.2206398E-03 7 0.2383747E-06 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.1214184E-12 1 0.1248998E-11 2 0.2052960E-11 3 0.7508221E-12 4 0.1853016E-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 -9 0 0.6229671E-16 1 0.3251650E-12 2 0.1411820E-11 3 0.4614268E-11 4 0.2575654E-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 0.3819317E-16 1 0.4128595E-12 2 0.2476464E-11 3 0.2087304E-11 4 0.1963781E-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 -7 0 0.2551574E-14 1 0.3764953E-13 2 0.6129994E-12 3 0.4997682E-11 4 0.1973352E-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 0.1194280E-16 1 0.1979303E-13 2 0.2274948E-13 3 0.1399137E-11 4 0.1008215E-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 0.2524525E-17 1 0.1522949E-12 2 0.1336807E-12 3 0.1973887E-12 4 0.1339395E-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 0.1871676E-12 1 0.1544103E-12 2 0.1705027E-12 3 0.3844144E-12 4 0.1767273E-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 -3 0 0.1209307E-18 1 0.1148142E-12 2 0.7074545E-12 3 0.1433502E-11 4 0.1490721E-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 -2 0 0.2737589E-18 1 0.4377027E-12 2 0.1182500E-11 3 0.1623074E-11 4 0.7324206E-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 -1 0 0.5306586E-13 1 0.2972324E-12 2 0.5119003E-11 3 0.1375368E-10 4 0.1658496E-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 0 0 0.1517139E-17 1 0.1263696E-11 2 0.1445142E-10 3 0.7665047E-10 4 0.6565244E-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 1 0 0.8054529E-18 1 0.2681324E-10 2 0.1974027E-10 3 0.1927070E-09 4 0.3260945E-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 0.9491406E-11 1 0.5720942E-10 2 0.2787463E-09 3 0.4497806E-09 4 0.9851135E-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 3 0 0.1175344E-17 1 0.2835562E-09 2 0.1633641E-08 3 0.2050453E-08 4 0.9367145E-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 4 0 0.1848694E-16 1 0.1050481E-08 2 0.4220669E-08 3 0.1737700E-07 4 0.1160573E-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 0.3687110E-08 1 0.9260322E-08 2 0.8316365E-08 3 0.3251877E-07 4 0.7369483E-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 0.3342117E-16 1 0.3621146E-07 2 0.5102681E-07 3 0.1563907E-06 4 0.1157588E-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 7 0 0.4836828E-17 1 0.8712531E-07 2 0.1120652E-06 3 0.2326644E-06 4 0.6568496E-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 8 0 0.4061884E-06 1 0.1119318E-05 2 0.6647355E-06 3 0.2533916E-06 4 0.1040282E-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 9 0 0.4739563E-16 1 0.1797917E-06 2 0.9275906E-06 3 0.9024705E-06 4 0.2834041E-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 10 0 0.2189992E-14 1 0.4870282E-06 2 0.1653011E-05 3 0.1719150E-05 4 0.3482838E-06 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 0.3440243E-12 1 0.1087896E-08 2 0.3791589E-08 3 0.4631895E-08 4 0.5276093E-08 5 0.8840582E-09 6 0.1802161E-08 7 0.1544673E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1696251E-12 1 0.4506997E-09 2 0.2187596E-08 3 0.1359250E-08 4 0.5343834E-09 5 0.2583350E-09 6 0.2937480E-09 7 0.4176777E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.3589952E-11 1 0.2716202E-09 2 0.7497645E-09 3 0.5351939E-09 4 0.3717478E-09 5 0.1852885E-09 6 0.1889322E-09 7 0.1410580E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.3521214E-12 1 0.2853514E-08 2 0.7826714E-08 3 0.3539151E-08 4 0.2511190E-08 5 0.2007633E-08 6 0.2574265E-08 7 0.1392174E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.4172369E-14 1 0.2131036E-07 2 0.7727984E-08 3 0.2566353E-07 4 0.3545385E-08 5 0.1765764E-08 6 0.3267128E-08 7 0.1138245E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.5812106E-07 1 0.1088765E-06 2 0.1469599E-06 3 0.1998841E-06 4 0.1060838E-06 5 0.2531377E-07 6 0.3525821E-08 7 0.1670043E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.2759857E-10 1 0.2227964E-10 2 0.4537665E-10 3 0.7394754E-11 4 0.1862165E-10 5 0.2359689E-10 6 0.5574728E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.6008313E-14 1 0.3640924E-10 2 0.7020458E-11 3 0.1246559E-10 4 0.8062330E-11 5 0.1990535E-10 6 0.1662578E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.2213929E-14 1 0.2167492E-10 2 0.6148905E-10 3 0.4283824E-10 4 0.2007185E-10 5 0.9550300E-10 6 0.6155017E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1982533E-12 1 0.9666771E-10 2 0.1605373E-09 3 0.6146945E-10 4 0.8345257E-10 5 0.1742211E-09 6 0.7212699E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.3453609E-13 1 0.1242986E-08 2 0.8976424E-09 3 0.4309768E-09 4 0.6791088E-09 5 0.1112351E-08 6 0.1942440E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.6081141E-15 1 0.2015075E-08 2 0.2860651E-08 3 0.1398375E-08 4 0.4615367E-08 5 0.2260945E-08 6 0.7277463E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.9112479E-08 1 0.1222704E-06 2 0.3012296E-07 3 0.2341375E-07 4 0.8622053E-08 5 0.2118546E-07 6 0.6317863E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.4992180E-13 1 0.1679145E-06 2 0.4124387E-06 3 0.1984441E-06 4 0.1523574E-06 5 0.1218630E-07 6 0.5456493E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1433947E-11 1 0.2122263E-06 2 0.5634408E-06 3 0.5849553E-06 4 0.2089443E-06 5 0.3770297E-07 6 0.6840194E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.4136574E-16 1 0.3230442E-13 2 0.3768717E-12 3 0.3634867E-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 = 1 6 -5 0 0.2344719E-18 1 0.1832219E-12 2 0.3930075E-12 3 0.8421629E-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 = 1 6 -4 0 0.1164988E-12 1 0.3005039E-12 2 0.2955809E-12 3 0.1704158E-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 = 1 6 -3 0 0.2662120E-17 1 0.2534814E-13 2 0.6416927E-12 3 0.1069260E-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 -2 0 0.8615279E-18 1 0.2596868E-12 2 0.1045767E-11 3 0.2432854E-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 -1 0 0.9494935E-13 1 0.1816093E-12 2 0.8744135E-11 3 0.6422986E-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 0 0 0.5242846E-16 1 0.1161665E-11 2 0.1346636E-09 3 0.5265359E-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 1 0 0.8994968E-19 1 0.6858519E-11 2 0.1499198E-09 3 0.2124179E-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 0.2511360E-09 1 0.6993737E-09 2 0.1565861E-08 3 0.2332432E-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 3 0 0.1585683E-16 1 0.7007118E-09 2 0.1388255E-08 3 0.1085880E-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 4 0 0.4264175E-15 1 0.8105551E-08 2 0.1757154E-07 3 0.5516977E-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 5 0 0.5757417E-08 1 0.3342905E-07 2 0.5138733E-07 3 0.2506922E-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 0.2187046E-15 1 0.1736283E-06 2 0.4184582E-07 3 0.2513762E-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 = 0.9979478 average vibrational energy (ev) = 0.000002 average rotational energy (ev) = 0.494672 average diffraction energy (ev) = 0.049952 the reaction probability = 0.2052193D-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 0.9753647E+00 0.5263591E-01 0.4930511E+00 1 0.3158834E-04 0.6429336E-01 0.1280039E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.6045364E-04 0 31 2 -2 0.5800933E-04 0 37 2 -1 0.2536628E-04 0 44 2 0 0.3257114E-04 0 50 2 1 0.8179552E-04 0 56 2 2 0.1524336E-03 0 21 4 -4 0.3169980E-04 0 26 4 -3 0.8227725E-05 0 32 4 -2 0.2933941E-05 0 38 4 -1 0.5365639E-05 0 45 4 0 0.1007662E-04 0 51 4 1 0.1974987E-04 0 57 4 2 0.1109478E-03 0 62 4 3 0.2215695E-03 0 67 4 4 0.4103467E-03 0 13 6 -6 0.1041145E-04 0 17 6 -5 0.3139277E-05 0 22 6 -4 0.1977341E-05 0 27 6 -3 0.4417059E-06 0 33 6 -2 0.1788073E-06 0 39 6 -1 0.4201692E-06 0 46 6 0 0.2689681E-05 0 52 6 1 0.1298377E-04 0 58 6 2 0.7331137E-04 0 63 6 3 0.3067265E-03 0 68 6 4 0.8020134E-03 0 72 6 5 0.1615308E-02 0 76 6 6 0.4415279E-02 0 7 8 -8 0.1181487E-06 0 10 8 -7 0.6934543E-07 0 14 8 -6 0.2909613E-07 0 18 8 -5 0.7112640E-08 0 23 8 -4 0.1549726E-08 0 28 8 -3 0.4983795E-09 0 34 8 -2 0.1785979E-08 0 40 8 -1 0.1283848E-07 0 47 8 0 0.7051012E-07 0 53 8 1 0.8150892E-06 0 59 8 2 0.2269949E-04 0 64 8 3 0.4381180E-03 0 69 8 4 0.5105843E-02 0 73 8 5 0.3333599E-01 0 77 8 6 0.1138203E+00 0 80 8 7 0.2659882E+00 0 83 8 8 0.5481597E+00 0 3 10 -10 0.1539803E-10 0 5 10 -9 0.2111779E-10 0 8 10 -8 0.1404120E-10 0 11 10 -7 0.1830771E-10 0 15 10 -6 0.1063657E-10 0 19 10 -5 0.1169791E-10 0 24 10 -4 0.1321344E-10 0 29 10 -3 0.1656681E-10 0 35 10 -2 0.7062783E-10 0 41 10 -1 0.2818603E-09 0 48 10 0 0.1120101E-08 0 54 10 1 0.3707424E-08 0 60 10 2 0.1318738E-07 0 65 10 3 0.3137374E-07 0 70 10 4 0.1603005E-06 0 74 10 5 0.3456243E-06 0 78 10 6 0.8522526E-06 0 81 10 7 0.1418672E-05 0 84 10 8 0.6465777E-05 0 86 10 9 0.3378971E-05 0 88 10 10 0.3619994E-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 0.4650726E-06 1 31 2 -2 0.3358472E-06 1 37 2 -1 0.5433257E-07 1 44 2 0 0.4519606E-06 1 50 2 1 0.6267195E-06 1 56 2 2 0.5352873E-05 1 21 4 -4 0.2897989E-07 1 26 4 -3 0.6512601E-08 1 32 4 -2 0.8927573E-08 1 38 4 -1 0.1021298E-07 1 45 4 0 0.3141823E-07 1 51 4 1 0.1509934E-06 1 57 4 2 0.1101928E-05 1 62 4 3 0.5798431E-05 1 67 4 4 0.1533338E-04 1 13 6 -6 0.9481862E-11 1 17 6 -5 0.8615833E-11 1 22 6 -4 0.1757172E-10 1 27 6 -3 0.1395811E-10 1 33 6 -2 0.3615180E-10 1 39 6 -1 0.2703385E-09 1 46 6 0 0.1273346E-08 1 52 6 1 0.2429186E-08 1 58 6 2 0.6896859E-08 1 63 6 3 0.1385743E-07 1 68 6 4 0.6990751E-07 1 72 6 5 0.2802862E-06 1 76 6 6 0.1455752E-05 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 0.3979706E-12 1 0.4183214E-05 2 0.4214641E-05 3 0.4515395E-05 4 0.1327117E-04 5 0.2012596E-04 6 0.9737020E-05 7 0.3663864E-05 8 0.7165569E-06 9 0.2581518E-07 v, j, mj = 0 2 -2 0 0.2693494E-11 1 0.9412371E-05 2 0.8931782E-05 3 0.6184973E-05 4 0.1036337E-04 5 0.1263442E-04 6 0.7821255E-05 7 0.2332462E-05 8 0.3194633E-06 9 0.9221109E-08 v, j, mj = 0 2 -1 0 0.8281742E-08 1 0.6798194E-06 2 0.2374097E-05 3 0.7300505E-05 4 0.8089320E-05 5 0.4746556E-05 6 0.1741983E-05 7 0.3958910E-06 8 0.2856294E-07 9 0.1267879E-08 v, j, mj = 0 2 0 0 0.2669752E-12 1 0.7728068E-05 2 0.8268578E-05 3 0.1008686E-04 4 0.6945346E-06 5 0.2290180E-05 6 0.2097663E-05 7 0.1084583E-05 8 0.3096568E-06 9 0.1101796E-07 v, j, mj = 0 2 1 0 0.1694725E-11 1 0.8079601E-06 2 0.8534732E-05 3 0.1563060E-04 4 0.2333333E-04 5 0.2101392E-04 6 0.9840683E-05 7 0.2396541E-05 8 0.2307911E-06 9 0.6965026E-08 v, j, mj = 0 2 2 0 0.7136882E-05 1 0.5110584E-05 2 0.2205108E-04 3 0.5920932E-05 4 0.1915843E-04 5 0.4474148E-04 6 0.3265946E-04 7 0.1252162E-04 8 0.2945608E-05 9 0.1875250E-06 v, j, mj = 0 4 -4 0 0.3867921E-05 1 0.2947557E-05 2 0.6857767E-05 3 0.3988777E-05 4 0.5751671E-05 5 0.5368613E-05 6 0.2400112E-05 7 0.4884369E-06 8 0.2844468E-07 9 0.5019307E-09 v, j, mj = 0 4 -3 0 0.3111048E-12 1 0.3996692E-06 2 0.1566577E-05 3 0.2452350E-05 4 0.2510638E-05 5 0.1034693E-05 6 0.2325704E-06 7 0.2810876E-07 8 0.2794469E-08 9 0.3224786E-09 v, j, mj = 0 4 -2 0 0.1511242E-11 1 0.2040706E-06 2 0.3755119E-06 3 0.7436274E-06 4 0.9402001E-06 5 0.3907429E-06 6 0.2013521E-06 7 0.6972318E-07 8 0.8157223E-08 9 0.5544610E-09 v, j, mj = 0 4 -1 0 0.9314297E-09 1 0.2092048E-06 2 0.3453284E-06 3 0.1861862E-05 4 0.2008346E-05 5 0.6715762E-06 6 0.2101398E-06 7 0.5303262E-07 8 0.3924130E-08 9 0.1293495E-08 v, j, mj = 0 4 0 0 0.1473915E-11 1 0.1243388E-05 2 0.5601793E-06 3 0.6681868E-05 4 0.1284089E-05 5 0.2371879E-06 6 0.4016878E-07 7 0.1595938E-07 8 0.1130036E-07 9 0.2481986E-08 v, j, mj = 0 4 1 0 0.6728904E-12 1 0.7403225E-06 2 0.4457638E-05 3 0.8975016E-05 4 0.2953340E-05 5 0.1280933E-05 6 0.9626725E-06 7 0.3429229E-06 8 0.3145486E-07 9 0.5566849E-08 v, j, mj = 0 4 2 0 0.2185386E-05 1 0.1000579E-05 2 0.3709515E-04 3 0.2666329E-04 4 0.2620437E-04 5 0.1292401E-04 6 0.4117743E-05 7 0.6907328E-06 8 0.6014611E-07 9 0.6421702E-08 v, j, mj = 0 4 3 0 0.8351790E-12 1 0.1414007E-05 2 0.1255841E-04 3 0.3683728E-04 4 0.4914886E-04 5 0.6349311E-04 6 0.4739140E-04 7 0.1026624E-04 8 0.4553861E-06 9 0.4781366E-08 v, j, mj = 0 4 4 0 0.2872207E-11 1 0.4767378E-04 2 0.6597956E-04 3 0.3726877E-04 4 0.2333104E-04 5 0.8530664E-04 6 0.1054186E-03 7 0.4169763E-04 8 0.3643532E-05 9 0.2715429E-07 v, j, mj = 0 6 -6 0 0.9679487E-11 1 0.1986742E-05 2 0.1093382E-05 3 0.1391328E-05 4 0.2703050E-05 5 0.2339111E-05 6 0.8283248E-06 7 0.6894736E-07 8 0.5128767E-09 9 0.3846384E-10 v, j, mj = 0 6 -5 0 0.7118535E-14 1 0.1963373E-07 2 0.2259821E-06 3 0.8087738E-06 4 0.1167259E-05 5 0.7513064E-06 6 0.1573138E-06 7 0.8749556E-08 8 0.1150793E-09 9 0.1438737E-09 v, j, mj = 0 6 -4 0 0.8544810E-07 1 0.1361987E-06 2 0.4098729E-06 3 0.5648740E-06 4 0.5270133E-06 5 0.2165898E-06 6 0.3356644E-07 7 0.3444197E-08 8 0.1507099E-09 9 0.1828692E-09 v, j, mj = 0 6 -3 0 0.1487619E-14 1 0.5011626E-07 2 0.1373615E-06 3 0.1440690E-06 4 0.8411866E-07 5 0.2208120E-07 6 0.3208324E-08 7 0.3711771E-09 8 0.1324221E-09 9 0.2473610E-09 v, j, mj = 0 6 -2 0 0.5583953E-12 1 0.5525477E-08 2 0.2692709E-07 3 0.7259026E-07 4 0.5403137E-07 5 0.1613758E-07 6 0.1414860E-08 7 0.9418154E-09 8 0.3880404E-09 9 0.8502783E-09 v, j, mj = 0 6 -1 0 0.4847060E-10 1 0.1281850E-06 2 0.1296100E-06 3 0.6122764E-07 4 0.8117774E-07 5 0.1427582E-07 6 0.3187024E-08 7 0.6337168E-09 8 0.6121292E-09 9 0.1211571E-08 v, j, mj = 0 6 0 0 0.2167847E-11 1 0.1085616E-05 2 0.5517702E-06 3 0.5688896E-06 4 0.4360752E-06 5 0.3458218E-07 6 0.7332664E-08 7 0.1486777E-08 8 0.1435231E-08 9 0.2490731E-08 v, j, mj = 0 6 1 0 0.5647683E-12 1 0.3108033E-05 2 0.9653097E-06 3 0.6826838E-05 4 0.1883340E-05 5 0.1683372E-06 6 0.1467662E-07 7 0.6309422E-08 8 0.5476827E-08 9 0.5446734E-08 v, j, mj = 0 6 2 0 0.3512587E-05 1 0.4532742E-06 2 0.1789986E-04 3 0.4061675E-04 4 0.8584571E-05 5 0.1898428E-05 6 0.2945302E-06 7 0.3366715E-07 8 0.1301085E-07 9 0.4695375E-08 v, j, mj = 0 6 3 0 0.2504208E-11 1 0.1380087E-05 2 0.1014691E-03 3 0.1040283E-03 4 0.6691122E-04 5 0.2722078E-04 6 0.5334377E-05 7 0.3492842E-06 8 0.2398616E-07 9 0.9446213E-08 v, j, mj = 0 6 4 0 0.1322219E-10 1 0.1122295E-04 2 0.8435356E-04 3 0.1996665E-03 4 0.2769226E-03 5 0.1882167E-03 6 0.3905542E-04 7 0.2489458E-05 8 0.5897442E-07 9 0.2723682E-07 v, j, mj = 0 6 5 0 0.1039813E-05 1 0.1105595E-03 2 0.8552996E-04 3 0.3619147E-04 4 0.5979091E-03 5 0.6147236E-03 6 0.1578343E-03 7 0.1124289E-04 8 0.2332174E-06 9 0.4422384E-07 v, j, mj = 0 6 6 0 0.2113800E-09 1 0.4111722E-03 2 0.4162399E-03 3 0.1479737E-02 4 0.4623400E-03 5 0.1149282E-02 6 0.4582697E-03 7 0.3770339E-04 8 0.4978798E-06 9 0.3643776E-07 v, j, mj = 0 8 -8 0 0.3702456E-11 1 0.4414919E-08 2 0.4356829E-08 3 0.3310841E-07 4 0.5911467E-07 5 0.1671721E-07 6 0.4175310E-09 7 0.8393454E-11 8 0.7055151E-11 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.6288612E-11 1 0.1196335E-09 2 0.4443333E-08 3 0.2708478E-07 4 0.3061704E-07 5 0.6797658E-08 6 0.2437504E-09 7 0.2177351E-10 8 0.1117423E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.3080728E-12 1 0.2826386E-08 2 0.8803387E-08 3 0.1121637E-07 4 0.5245147E-08 5 0.8930412E-09 6 0.7321402E-10 7 0.2474399E-10 8 0.1352842E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.2161993E-12 1 0.1217723E-08 2 0.3061637E-08 3 0.1882113E-08 4 0.6680642E-09 5 0.1860147E-09 6 0.5267294E-10 7 0.1905516E-10 8 0.2514459E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.2827551E-09 1 0.2719920E-09 2 0.2199546E-09 3 0.2867110E-09 4 0.2542669E-09 5 0.1505139E-09 6 0.2321304E-10 7 0.4504650E-10 8 0.1527261E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.9509807E-14 1 0.2499703E-10 2 0.8458172E-10 3 0.1100610E-09 4 0.6083446E-10 5 0.5023240E-10 6 0.3991406E-10 7 0.7066460E-10 8 0.5708474E-10 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.1540376E-13 1 0.9548269E-10 2 0.8101998E-09 3 0.2337435E-09 4 0.9616055E-10 5 0.5896333E-10 6 0.8204442E-10 7 0.2787727E-09 8 0.1305966E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.5748878E-11 1 0.3715661E-08 2 0.5810173E-08 3 0.4637249E-09 4 0.6028023E-09 5 0.4592459E-09 6 0.4576159E-09 7 0.8193092E-09 8 0.5042030E-09 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.9958745E-13 1 0.3204401E-07 2 0.1296224E-07 3 0.4198368E-08 4 0.9820947E-08 5 0.3312281E-08 6 0.9300620E-09 7 0.5036564E-08 8 0.2205547E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3624759E-13 1 0.7749621E-07 2 0.4685966E-07 3 0.2750736E-06 4 0.3570058E-06 5 0.3997213E-07 6 0.3555509E-08 7 0.1115482E-07 8 0.3971402E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.4036294E-06 1 0.5409772E-07 2 0.1706411E-05 3 0.1183621E-04 4 0.7806514E-05 5 0.8085483E-06 6 0.2538345E-07 7 0.5423704E-07 8 0.4461035E-08 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.1785107E-12 1 0.5380130E-05 2 0.6542672E-04 3 0.2357427E-03 4 0.1181299E-03 5 0.1294472E-04 6 0.3873836E-06 7 0.9916287E-07 8 0.7273974E-08 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.6382702E-11 1 0.3306969E-04 2 0.1065063E-02 3 0.2625998E-02 4 0.1238328E-02 5 0.1397608E-03 6 0.3429572E-05 7 0.1899497E-06 8 0.4394786E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.2825790E-06 1 0.1899577E-03 2 0.6656349E-02 3 0.1720776E-01 4 0.8232513E-02 5 0.1020426E-02 6 0.2854114E-04 7 0.1592796E-06 8 0.4852567E-08 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.2946472E-10 1 0.6486938E-03 2 0.1698264E-01 3 0.5564432E-01 4 0.3495008E-01 5 0.5430400E-02 6 0.1636149E-03 7 0.5058717E-06 8 0.5676575E-08 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.9104555E-12 1 0.3781867E-01 2 0.4979636E-01 3 0.6131089E-01 4 0.9748295E-01 5 0.1899342E-01 6 0.5836560E-03 7 0.2246550E-05 8 0.8211204E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.1111829E+00 1 0.9777350E-01 2 0.2334496E+00 3 0.3308367E-01 4 0.4317716E-01 5 0.2831852E-01 6 0.1170077E-02 7 0.4288601E-05 8 0.2931434E-08 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.5525047E-11 1 0.1459942E-11 2 0.2245024E-11 3 0.1963201E-11 4 0.1377919E-11 5 0.2826892E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.1246886E-13 1 0.8695906E-12 2 0.2738088E-11 3 0.1430457E-11 4 0.9451715E-11 5 0.6615473E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.2634763E-14 1 0.1052348E-11 2 0.2767249E-11 3 0.3448408E-11 4 0.2831765E-11 5 0.3938799E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.7554624E-13 1 0.7400677E-12 2 0.5245820E-12 3 0.2418311E-11 4 0.5982721E-11 5 0.8566480E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.9779152E-16 1 0.2082918E-13 2 0.5090966E-12 3 0.1970147E-11 4 0.6271445E-11 5 0.1864959E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.2451579E-16 1 0.5643973E-12 2 0.1677400E-11 3 0.1754669E-11 4 0.4197851E-11 5 0.3503568E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.5089361E-12 1 0.1972164E-11 2 0.3536033E-11 3 0.1871114E-11 4 0.2297658E-11 5 0.3027539E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.2033006E-16 1 0.5896188E-13 2 0.2798744E-11 3 0.2689356E-11 4 0.4238208E-11 5 0.6781515E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.6038665E-17 1 0.2936147E-11 2 0.3847043E-11 3 0.7341738E-11 4 0.1801259E-10 5 0.3849030E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.5951802E-13 1 0.1169648E-10 2 0.2468211E-10 3 0.5682000E-10 4 0.5888963E-10 5 0.1297126E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.1016832E-16 1 0.6735484E-11 2 0.7626312E-10 3 0.3436413E-09 4 0.2527246E-09 5 0.4407365E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.9034246E-17 1 0.1398864E-10 2 0.1627438E-09 3 0.8193014E-09 4 0.7079938E-09 5 0.2003397E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.2498230E-09 1 0.6196370E-10 2 0.1322670E-08 3 0.2916389E-08 4 0.3608248E-08 5 0.5028286E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.8862520E-16 1 0.9425708E-09 2 0.6046586E-08 3 0.8425794E-08 4 0.6988127E-08 5 0.8970663E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.9568552E-15 1 0.5924537E-08 2 0.2373251E-07 3 0.6035051E-07 4 0.4190167E-07 5 0.2839132E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.2511456E-08 1 0.8431337E-08 2 0.5313872E-07 3 0.1499250E-06 4 0.9938859E-07 5 0.3222920E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.3279513E-14 1 0.1543081E-06 2 0.4789098E-06 3 0.8231858E-07 4 0.5898824E-07 5 0.7772777E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.3942028E-15 1 0.2068038E-06 2 0.7457405E-06 3 0.3017307E-06 4 0.8900902E-07 5 0.7538812E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.4627691E-06 1 0.2771930E-05 2 0.1910368E-05 3 0.1076589E-05 4 0.1841367E-06 5 0.5998361E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1656800E-13 1 0.6077792E-06 2 0.1881463E-05 3 0.6874449E-06 4 0.7816449E-07 5 0.1241197E-06 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.2702131E-11 1 0.1661100E-06 2 0.2334574E-05 3 0.6676502E-06 4 0.3584934E-06 5 0.9316340E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.2040223E-11 1 0.9344991E-08 2 0.6224969E-07 3 0.9566683E-07 4 0.9971190E-07 5 0.1873359E-06 6 0.9504243E-08 7 0.1142510E-08 8 0.1145229E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.1631458E-11 1 0.5215020E-07 2 0.3604004E-07 3 0.1488039E-06 4 0.6351588E-07 5 0.3336618E-07 6 0.1696480E-08 7 0.2729093E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.8016763E-10 1 0.9875888E-08 2 0.1500207E-07 3 0.1995146E-07 4 0.5451092E-08 5 0.3125628E-08 6 0.5015656E-09 7 0.3446930E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1434302E-11 1 0.3717272E-07 2 0.4424839E-07 3 0.1236684E-06 4 0.1192168E-06 5 0.1216914E-06 6 0.4930344E-08 7 0.1031082E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.3370248E-12 1 0.7996302E-08 2 0.7495170E-07 3 0.1209048E-06 4 0.3978937E-06 5 0.2111990E-07 6 0.2538778E-08 7 0.1314042E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1081721E-07 1 0.6141685E-06 2 0.1916295E-06 3 0.7096179E-06 4 0.2972937E-05 5 0.8228065E-06 6 0.2845472E-07 7 0.2441631E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.1750426E-09 1 0.8382766E-09 2 0.4489738E-08 3 0.1973916E-07 4 0.3521280E-08 5 0.1584934E-09 6 0.5790195E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.8632521E-13 1 0.1811663E-10 2 0.2698490E-08 3 0.2780072E-08 4 0.9223882E-09 5 0.5851691E-10 6 0.3493128E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.1289468E-12 1 0.3373774E-08 2 0.1009225E-08 3 0.3235834E-08 4 0.8680381E-09 5 0.3750652E-09 6 0.6550724E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.3525722E-10 1 0.2177460E-08 2 0.3467104E-08 3 0.3425469E-08 4 0.3901637E-09 5 0.2516259E-09 6 0.4659018E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.7901488E-13 1 0.7853461E-08 2 0.8862546E-09 3 0.1599652E-07 4 0.4570454E-08 5 0.1520768E-08 6 0.5906880E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1232958E-13 1 0.7944999E-07 2 0.3720273E-08 3 0.2820616E-07 4 0.2729034E-07 5 0.9103027E-08 6 0.3223559E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.1977010E-06 1 0.4601749E-07 2 0.3345199E-06 3 0.3838867E-06 4 0.1146930E-06 5 0.2257253E-07 6 0.2537135E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.6105817E-12 1 0.1247241E-05 2 0.1028256E-05 3 0.2728920E-05 4 0.7405333E-06 5 0.4921571E-07 6 0.4265219E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.1946468E-11 1 0.8444940E-06 2 0.3866351E-05 3 0.7126238E-05 4 0.3325658E-05 5 0.1635973E-06 6 0.7036168E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.1755488E-12 1 0.1113029E-11 2 0.1062580E-11 3 0.3985396E-11 4 0.3145308E-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 6 -5 0 0.6235364E-14 1 0.1763944E-11 2 0.1628199E-11 3 0.2386563E-11 4 0.2830892E-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 6 -4 0 0.2916851E-11 1 0.1725134E-11 2 0.9610546E-11 3 0.1019028E-11 4 0.2300159E-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 6 -3 0 0.1367351E-15 1 0.1808616E-11 2 0.3165514E-11 3 0.3585106E-11 4 0.5398735E-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 6 -2 0 0.4852854E-16 1 0.5411787E-11 2 0.6131070E-11 3 0.4925303E-11 4 0.1968359E-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 0.2332387E-11 1 0.1040125E-10 2 0.8820393E-11 3 0.8961906E-10 4 0.1591654E-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 0.4471171E-15 1 0.4618410E-10 2 0.9711610E-10 3 0.5554521E-09 4 0.5745934E-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 0.1262773E-16 1 0.1829260E-10 2 0.2971136E-09 3 0.9910137E-09 4 0.1122766E-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 0.1304817E-08 1 0.8446579E-09 2 0.2521551E-08 3 0.8219426E-09 4 0.1403890E-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 0.6361949E-15 1 0.2897616E-08 2 0.2862025E-08 3 0.2997599E-08 4 0.5100191E-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 4 0 0.5122846E-14 1 0.6641974E-08 2 0.4059174E-07 3 0.1343741E-07 4 0.9236383E-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 5 0 0.2138843E-07 1 0.6610423E-07 2 0.1085265E-06 3 0.5703477E-07 4 0.2723229E-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 6 0 0.3634231E-11 1 0.6761494E-06 2 0.6965073E-06 3 0.5719463E-07 4 0.2589723E-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 = 0.9753963 average vibrational energy (ev) = 0.000016 average rotational energy (ev) = 0.493039 average diffraction energy (ev) = 0.052636 the reaction probability = 0.2460372D-01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38986810D+01 trans energy = 0.49285714D+00 trans energy in z = 0.49285714D+00 total momentum = 0.11536724D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.8049224E+00 0.5388765E-01 0.4836944E+00 1 0.1522973E-02 0.5538679E-01 0.2263964E+00 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 43 0 0 0.6118789E-03 0 31 2 -2 0.5649846E-03 0 37 2 -1 0.3157212E-03 0 44 2 0 0.3629169E-03 0 50 2 1 0.8323556E-03 0 56 2 2 0.1131496E-02 0 21 4 -4 0.3617332E-03 0 26 4 -3 0.1120501E-03 0 32 4 -2 0.6348325E-04 0 38 4 -1 0.5589573E-04 0 45 4 0 0.1224898E-03 0 51 4 1 0.2075377E-03 0 57 4 2 0.1083477E-02 0 62 4 3 0.1644612E-02 0 67 4 4 0.2584913E-02 0 13 6 -6 0.1805990E-03 0 17 6 -5 0.5842943E-04 0 22 6 -4 0.3572541E-04 0 27 6 -3 0.1058955E-04 0 33 6 -2 0.4614486E-05 0 39 6 -1 0.3267572E-05 0 46 6 0 0.1872770E-04 0 52 6 1 0.1019023E-03 0 58 6 2 0.4764286E-03 0 63 6 3 0.1763169E-02 0 68 6 4 0.3925821E-02 0 72 6 5 0.5624305E-02 0 76 6 6 0.1380106E-01 0 7 8 -8 0.1152286E-04 0 10 8 -7 0.6828727E-05 0 14 8 -6 0.3080375E-05 0 18 8 -5 0.6280348E-06 0 23 8 -4 0.1205413E-06 0 28 8 -3 0.3155359E-07 0 34 8 -2 0.2621956E-07 0 40 8 -1 0.1025275E-06 0 47 8 0 0.5608165E-06 0 53 8 1 0.1230779E-04 0 59 8 2 0.2318054E-03 0 64 8 3 0.2788928E-02 0 69 8 4 0.1946762E-01 0 73 8 5 0.7199665E-01 0 77 8 6 0.1378378E+00 0 80 8 7 0.1613076E+00 0 83 8 8 0.3750639E+00 0 3 10 -10 0.1061556E-08 0 5 10 -9 0.5112621E-09 0 8 10 -8 0.1744387E-09 0 11 10 -7 0.1379865E-09 0 15 10 -6 0.1306988E-09 0 19 10 -5 0.1016277E-09 0 24 10 -4 0.8533914E-10 0 29 10 -3 0.1192677E-09 0 35 10 -2 0.3172254E-09 0 41 10 -1 0.1063731E-08 0 48 10 0 0.2953803E-08 0 54 10 1 0.9835680E-08 0 60 10 2 0.5102170E-07 0 65 10 3 0.2544627E-06 0 70 10 4 0.7714275E-06 0 74 10 5 0.2011446E-05 0 78 10 6 0.8538486E-05 0 81 10 7 0.1531028E-05 0 84 10 8 0.3868517E-04 0 86 10 9 0.3821366E-04 0 88 10 10 0.4267700E-04 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 0.3842935E-04 1 31 2 -2 0.3816257E-04 1 37 2 -1 0.7904277E-05 1 44 2 0 0.2711053E-04 1 50 2 1 0.4122947E-04 1 56 2 2 0.1072787E-03 1 21 4 -4 0.5520927E-05 1 26 4 -3 0.2368777E-05 1 32 4 -2 0.2299599E-05 1 38 4 -1 0.6115276E-06 1 45 4 0 0.1747177E-05 1 51 4 1 0.5251014E-05 1 57 4 2 0.1395548E-04 1 62 4 3 0.3992811E-04 1 67 4 4 0.1738374E-03 1 13 6 -6 0.3835898E-07 1 17 6 -5 0.4520664E-07 1 22 6 -4 0.1421936E-07 1 27 6 -3 0.4991862E-08 1 33 6 -2 0.2645812E-08 1 39 6 -1 0.1805100E-08 1 46 6 0 0.4347159E-08 1 52 6 1 0.9295623E-08 1 58 6 2 0.3659872E-07 1 63 6 3 0.1637248E-06 1 68 6 4 0.4340932E-05 1 72 6 5 0.7806060E-04 1 76 6 6 0.9344489E-03 1 7 8 -8 0.2856222E-13 1 10 8 -7 0.7711096E-13 1 14 8 -6 0.7200883E-13 1 18 8 -5 0.5297246E-13 1 23 8 -4 0.5381546E-12 1 28 8 -3 0.2662126E-13 1 34 8 -2 0.1986435E-13 1 40 8 -1 0.1900663E-12 1 47 8 0 0.9917228E-13 1 53 8 1 0.1333343E-12 1 59 8 2 0.2283789E-11 1 64 8 3 0.3982266E-11 1 69 8 4 0.6793128E-11 1 73 8 5 0.1887925E-09 1 77 8 6 0.2382629E-10 1 80 8 7 0.9311795E-09 1 83 8 8 0.1657513E-06 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 0.5425634E-10 1 0.3560017E-04 2 0.4591368E-04 3 0.4257056E-04 4 0.8133566E-04 5 0.2204724E-03 6 0.1344767E-03 7 0.4260138E-04 8 0.8425264E-05 9 0.4830795E-06 v, j, mj = 0 2 -2 0 0.2661777E-10 1 0.9537123E-04 2 0.8836666E-04 3 0.7638505E-04 4 0.6067350E-04 5 0.1379145E-03 6 0.7899948E-04 7 0.2389282E-04 8 0.3259121E-05 9 0.1221786E-06 v, j, mj = 0 2 -1 0 0.1391400E-06 1 0.1028950E-04 2 0.2378558E-04 3 0.7576488E-04 4 0.9435405E-04 5 0.7302675E-04 6 0.3010556E-04 7 0.7472331E-05 8 0.7654291E-06 9 0.1797026E-07 v, j, mj = 0 2 0 0 0.1314777E-11 1 0.7530739E-04 2 0.7709881E-04 3 0.1338287E-03 4 0.1221496E-04 5 0.2069969E-04 6 0.2738724E-04 7 0.1310733E-04 8 0.3079991E-05 9 0.1927154E-06 v, j, mj = 0 2 1 0 0.2191492E-11 1 0.7605361E-05 2 0.8010315E-04 3 0.1581733E-03 4 0.2417924E-03 5 0.2069961E-03 6 0.9939085E-04 7 0.3386697E-04 8 0.4272817E-05 9 0.1547402E-06 v, j, mj = 0 2 2 0 0.4850592E-04 1 0.4610250E-04 2 0.1305708E-03 3 0.5193332E-04 4 0.6347933E-04 5 0.3784673E-03 6 0.2675190E-03 7 0.1132944E-03 8 0.2923926E-04 9 0.2383959E-05 v, j, mj = 0 4 -4 0 0.3708687E-04 1 0.2967308E-04 2 0.8793202E-04 3 0.3157822E-04 4 0.5511650E-04 5 0.6892234E-04 6 0.3980670E-04 7 0.1064852E-04 8 0.9546396E-06 9 0.1429314E-07 v, j, mj = 0 4 -3 0 0.5146133E-10 1 0.3362074E-05 2 0.2097321E-04 3 0.2834769E-04 4 0.3437121E-04 5 0.2026040E-04 6 0.4178988E-05 7 0.5272187E-06 8 0.2848820E-07 9 0.8031319E-09 v, j, mj = 0 4 -2 0 0.8804512E-10 1 0.4576762E-05 2 0.8257435E-05 3 0.2082832E-04 4 0.1758373E-04 5 0.8820560E-05 6 0.2727665E-05 7 0.6091344E-06 8 0.7757156E-07 9 0.1990425E-08 v, j, mj = 0 4 -1 0 0.7389309E-07 1 0.3259755E-06 2 0.4935602E-05 3 0.1173670E-04 4 0.1726096E-04 5 0.1582642E-04 6 0.4506012E-05 7 0.1106238E-05 8 0.1222011E-06 9 0.1716875E-08 v, j, mj = 0 4 0 0 0.4159531E-10 1 0.8010989E-05 2 0.8374494E-05 3 0.7629960E-04 4 0.2131804E-04 5 0.7626370E-05 6 0.5011406E-06 7 0.2631662E-06 8 0.8834369E-07 9 0.7596787E-08 v, j, mj = 0 4 1 0 0.1480621E-11 1 0.3379127E-05 2 0.4175573E-04 3 0.7597382E-04 4 0.4971881E-04 5 0.2000472E-04 6 0.1111365E-04 7 0.4957503E-05 8 0.6126113E-06 9 0.2177877E-07 v, j, mj = 0 4 2 0 0.1111348E-04 1 0.1419609E-04 2 0.3082890E-03 3 0.3036905E-03 4 0.2494397E-03 5 0.1479229E-03 6 0.4047633E-04 7 0.7415447E-05 8 0.8899341E-06 9 0.4309319E-07 v, j, mj = 0 4 3 0 0.3710798E-10 1 0.1331713E-04 2 0.1001979E-03 3 0.2152892E-03 4 0.4061309E-03 5 0.4617352E-03 6 0.3355195E-03 7 0.1036408E-03 8 0.8717030E-05 9 0.6411806E-07 v, j, mj = 0 4 4 0 0.1848343E-10 1 0.2527142E-03 2 0.3593756E-03 3 0.2822054E-03 4 0.7958466E-04 5 0.5381845E-03 6 0.6811124E-03 7 0.3388718E-03 8 0.5176896E-04 9 0.1095647E-05 v, j, mj = 0 6 -6 0 0.1110313E-10 1 0.4204008E-04 2 0.2742850E-04 3 0.1761970E-04 4 0.3363531E-04 5 0.3857636E-04 6 0.1848956E-04 7 0.2749470E-05 8 0.5988797E-07 9 0.1273117E-09 v, j, mj = 0 6 -5 0 0.2498703E-10 1 0.1260908E-05 2 0.4330746E-05 3 0.1321204E-04 4 0.2028416E-04 5 0.1465560E-04 6 0.4284761E-05 7 0.3928204E-06 8 0.8247062E-08 9 0.1180782E-09 v, j, mj = 0 6 -4 0 0.1102660E-05 1 0.1292592E-05 2 0.4459497E-05 3 0.7962904E-05 4 0.1198876E-04 5 0.7072433E-05 6 0.1658417E-05 7 0.1825719E-06 8 0.5352897E-08 9 0.2231655E-09 v, j, mj = 0 6 -3 0 0.6583440E-11 1 0.2633119E-06 2 0.2283177E-05 3 0.3221468E-05 4 0.3154036E-05 5 0.1382867E-05 6 0.2691709E-06 7 0.1478197E-07 8 0.4107926E-09 9 0.3180784E-09 v, j, mj = 0 6 -2 0 0.1199317E-11 1 0.1778073E-06 2 0.1563211E-05 3 0.1272506E-05 4 0.7796899E-06 5 0.6935978E-06 6 0.1184433E-06 7 0.7846619E-08 8 0.6717419E-09 9 0.7117375E-09 v, j, mj = 0 6 -1 0 0.4609210E-08 1 0.3385024E-06 2 0.6779187E-06 3 0.1078126E-05 4 0.4708312E-06 5 0.5746657E-06 6 0.1068500E-06 7 0.1366912E-07 8 0.9755702E-09 9 0.1423929E-08 v, j, mj = 0 6 0 0 0.1821997E-11 1 0.5219486E-05 2 0.4482362E-05 3 0.4417207E-05 4 0.3930025E-05 5 0.5803353E-06 6 0.8708003E-07 7 0.6874623E-08 8 0.1871527E-08 9 0.2456214E-08 v, j, mj = 0 6 1 0 0.3620858E-11 1 0.8201233E-05 2 0.1292029E-04 3 0.7005719E-04 4 0.8360267E-05 5 0.1955265E-05 6 0.3363813E-06 7 0.6304829E-07 8 0.4684087E-08 9 0.3913082E-08 v, j, mj = 0 6 2 0 0.7015124E-05 1 0.2226929E-05 2 0.1645670E-03 3 0.2306053E-03 4 0.5240763E-04 5 0.1658558E-04 6 0.2766386E-05 7 0.2372177E-06 8 0.1363525E-07 9 0.3716988E-08 v, j, mj = 0 6 3 0 0.1105826E-10 1 0.1786564E-04 2 0.6472201E-03 3 0.4650725E-03 4 0.4105384E-03 5 0.1857978E-03 6 0.3355177E-04 7 0.3040932E-05 8 0.7012560E-07 9 0.1201998E-07 v, j, mj = 0 6 4 0 0.8128181E-10 1 0.5628245E-04 2 0.4322401E-03 3 0.9021787E-03 4 0.1436420E-02 5 0.8761550E-03 6 0.2028195E-03 7 0.1918110E-04 8 0.5057448E-06 9 0.3809895E-07 v, j, mj = 0 6 5 0 0.3891299E-05 1 0.2718533E-03 2 0.3318433E-03 3 0.1191799E-03 4 0.1780945E-02 5 0.2182138E-02 6 0.8343340E-03 7 0.9757169E-04 8 0.2486692E-05 9 0.6133143E-07 v, j, mj = 0 6 6 0 0.7680675E-09 1 0.7401305E-03 2 0.2539810E-02 3 0.4289210E-02 4 0.6878730E-03 5 0.2916821E-02 6 0.2234030E-02 7 0.3829890E-03 8 0.1015255E-04 9 0.4627259E-07 v, j, mj = 0 8 -8 0 0.2724366E-10 1 0.1165274E-05 2 0.4958390E-06 3 0.7883947E-06 4 0.4700627E-05 5 0.3960582E-05 6 0.4077479E-06 7 0.4351748E-08 8 0.1680778E-10 9 0.0000000E+00 v, j, mj = 0 8 -7 0 0.1310891E-08 1 0.1997240E-07 2 0.5644295E-07 3 0.1461165E-05 4 0.3490843E-05 5 0.1660271E-05 6 0.1371676E-06 7 0.1497511E-08 8 0.5683223E-10 9 0.0000000E+00 v, j, mj = 0 8 -6 0 0.1177503E-11 1 0.1008034E-06 2 0.4211746E-06 3 0.1237556E-05 4 0.1065876E-05 5 0.2414125E-06 6 0.1340185E-07 7 0.1141497E-09 8 0.3516465E-10 9 0.0000000E+00 v, j, mj = 0 8 -5 0 0.6924840E-12 1 0.8382170E-08 2 0.2093091E-06 3 0.2597302E-06 4 0.1310558E-06 5 0.1824682E-07 6 0.1237072E-08 7 0.3086074E-10 8 0.4212230E-10 9 0.0000000E+00 v, j, mj = 0 8 -4 0 0.2862118E-08 1 0.2173267E-07 2 0.4116943E-07 3 0.3548110E-07 4 0.1355726E-07 5 0.5111356E-08 6 0.4966962E-09 7 0.4214572E-10 8 0.8856935E-10 9 0.0000000E+00 v, j, mj = 0 8 -3 0 0.2563109E-12 1 0.2598128E-08 2 0.7236288E-08 3 0.1330992E-07 4 0.5939681E-08 5 0.1976054E-08 6 0.2292409E-09 7 0.1538849E-09 8 0.1101374E-09 9 0.0000000E+00 v, j, mj = 0 8 -2 0 0.8148788E-13 1 0.2124970E-09 2 0.1249113E-07 3 0.8290462E-08 4 0.2169439E-08 5 0.1833600E-08 6 0.4205536E-09 7 0.4301409E-09 8 0.3716534E-09 9 0.0000000E+00 v, j, mj = 0 8 -1 0 0.1564814E-09 1 0.4122253E-07 2 0.3569308E-07 3 0.7713608E-08 4 0.1100205E-07 5 0.4003705E-08 6 0.6195186E-09 7 0.9861433E-09 8 0.1130375E-08 9 0.0000000E+00 v, j, mj = 0 8 0 0 0.5303629E-13 1 0.1158688E-06 2 0.2047899E-07 3 0.1567402E-06 4 0.2184654E-06 5 0.4026552E-07 6 0.1322693E-08 7 0.4168724E-08 8 0.3506161E-08 9 0.0000000E+00 v, j, mj = 0 8 1 0 0.3444150E-12 1 0.5037357E-06 2 0.1246760E-05 3 0.5256544E-05 4 0.4775506E-05 5 0.4982399E-06 6 0.1155500E-07 7 0.8810360E-08 8 0.6634601E-08 9 0.0000000E+00 v, j, mj = 0 8 2 0 0.6594140E-05 1 0.1428966E-05 2 0.2479415E-04 3 0.1302248E-03 4 0.6210400E-04 5 0.6390873E-05 6 0.2192998E-06 7 0.3894114E-07 8 0.1025711E-07 9 0.0000000E+00 v, j, mj = 0 8 3 0 0.2891371E-11 1 0.6867161E-04 2 0.5748209E-03 3 0.1499193E-02 4 0.5807969E-03 5 0.6315345E-04 6 0.2165053E-05 7 0.1159391E-06 8 0.1080351E-07 9 0.0000000E+00 v, j, mj = 0 8 4 0 0.5560544E-10 1 0.1618390E-03 2 0.5661055E-02 3 0.9620339E-02 4 0.3570277E-02 5 0.4367167E-03 6 0.1698396E-04 7 0.4009142E-06 8 0.9028895E-08 9 0.0000000E+00 v, j, mj = 0 8 5 0 0.3102793E-06 1 0.8053838E-03 2 0.1967212E-01 3 0.3536713E-01 4 0.1399239E-01 5 0.2058742E-02 6 0.9927244E-04 7 0.1295779E-05 8 0.1679320E-07 9 0.0000000E+00 v, j, mj = 0 8 6 0 0.1176169E-09 1 0.1451626E-02 2 0.3084166E-01 3 0.6177265E-01 4 0.3594263E-01 5 0.7375587E-02 6 0.4487056E-03 7 0.4891370E-05 8 0.1706368E-07 9 0.0000000E+00 v, j, mj = 0 8 7 0 0.1021755E-10 1 0.3316524E-01 2 0.3716825E-01 3 0.1906683E-01 4 0.4922466E-01 5 0.2115025E-01 6 0.1516859E-02 7 0.1547912E-04 8 0.8182541E-08 9 0.0000000E+00 v, j, mj = 0 8 8 0 0.8862670E-01 1 0.1214733E+00 2 0.1037007E+00 3 0.2884541E-01 4 0.7114227E-02 5 0.2198515E-01 6 0.3281848E-02 7 0.3654427E-04 8 0.2641541E-07 9 0.0000000E+00 v, j, mj = 0 10 -10 0 0.2202136E-10 1 0.5771011E-10 2 0.6214595E-09 3 0.3114649E-09 4 0.3680524E-10 5 0.9273302E-11 6 0.2821469E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -9 0 0.4927328E-12 1 0.5465247E-10 2 0.3382623E-09 3 0.7339608E-10 4 0.2316701E-10 5 0.1845147E-10 6 0.2840035E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -8 0 0.3138245E-13 1 0.7195957E-11 2 0.5538938E-10 3 0.6634110E-10 4 0.2089792E-10 5 0.2188620E-10 6 0.2696731E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -7 0 0.9710889E-13 1 0.1611891E-10 2 0.1925423E-10 3 0.3821581E-10 4 0.4305326E-10 5 0.1240764E-10 6 0.8839522E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -6 0 0.1443260E-14 1 0.2561880E-11 2 0.1744280E-10 3 0.4105137E-10 4 0.3167306E-10 5 0.3322160E-10 6 0.4746687E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -5 0 0.5797981E-15 1 0.1121417E-10 2 0.1841011E-10 3 0.3377842E-10 4 0.1637631E-10 5 0.1661473E-10 6 0.5233330E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -4 0 0.2658964E-11 1 0.2201695E-10 2 0.1866071E-10 3 0.1751692E-10 4 0.5943656E-11 5 0.1374918E-10 6 0.4792748E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -3 0 0.7616477E-15 1 0.2226271E-11 2 0.3056415E-10 3 0.2203959E-10 4 0.3245168E-10 5 0.2395359E-10 6 0.8031694E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -2 0 0.5415603E-15 1 0.1569321E-10 2 0.3203486E-10 3 0.9849144E-10 4 0.1050206E-09 5 0.5180351E-10 6 0.1418132E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 -1 0 0.2151834E-12 1 0.5398960E-10 2 0.8877289E-10 3 0.2836917E-09 4 0.2689133E-09 5 0.2680923E-09 6 0.1000565E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 0 0 0.4677219E-15 1 0.2624173E-10 2 0.5175792E-09 3 0.1418149E-08 4 0.3548243E-09 5 0.5198710E-09 6 0.1171374E-09 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 1 0 0.1346922E-15 1 0.3109066E-09 2 0.1088228E-08 3 0.2508325E-08 4 0.1925848E-08 5 0.2544606E-08 6 0.1457768E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 2 0 0.4467481E-08 1 0.1491878E-08 2 0.9864899E-08 3 0.1756943E-07 4 0.1193709E-07 5 0.4652060E-08 6 0.1038871E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 3 0 0.2375253E-14 1 0.1107188E-07 2 0.6897001E-07 3 0.1080036E-06 4 0.4685643E-07 5 0.1287525E-07 6 0.6685502E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 4 0 0.5494856E-13 1 0.1385545E-07 2 0.1659043E-06 3 0.4083551E-06 4 0.1329603E-06 5 0.4522324E-07 6 0.5129029E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 5 0 0.7268866E-08 1 0.6990473E-07 2 0.6557494E-06 3 0.1130073E-05 4 0.9003085E-07 5 0.5313503E-07 6 0.5284567E-08 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 6 0 0.8498567E-13 1 0.2057327E-05 2 0.3928182E-05 3 0.2311416E-05 4 0.1752064E-06 5 0.3742811E-07 6 0.2892606E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 7 0 0.1788542E-13 1 0.5371367E-06 2 0.5436239E-06 3 0.2423913E-06 4 0.1316678E-06 5 0.2917612E-07 6 0.4703188E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 8 0 0.2440613E-05 1 0.1959438E-04 2 0.1176237E-04 3 0.4195273E-05 4 0.6116948E-06 5 0.5560388E-07 6 0.2524179E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 9 0 0.1901137E-12 1 0.9451189E-05 2 0.2060392E-04 3 0.7636403E-05 4 0.3627277E-06 5 0.1258840E-06 6 0.3352837E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 10 10 0 0.1842856E-10 1 0.6197052E-05 2 0.2032370E-04 3 0.1523273E-04 4 0.8364402E-06 5 0.5502576E-07 6 0.3202890E-07 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 0 0 0 0.7068937E-10 1 0.1141295E-05 2 0.2286164E-05 3 0.6306947E-05 4 0.3212603E-05 5 0.2075590E-04 6 0.4673808E-05 7 0.5223970E-07 8 0.3251123E-09 9 0.0000000E+00 v, j, mj = 1 2 -2 0 0.6473483E-10 1 0.6283436E-05 2 0.3953049E-05 3 0.7741941E-05 4 0.4027898E-05 5 0.1497871E-04 6 0.1172993E-05 7 0.4439297E-08 8 0.4247650E-10 9 0.0000000E+00 v, j, mj = 1 2 -1 0 0.4662548E-08 1 0.5831093E-07 2 0.7520248E-06 3 0.2076191E-05 4 0.3159465E-05 5 0.1787427E-05 6 0.6567521E-07 7 0.4061969E-09 8 0.1135590E-09 9 0.0000000E+00 v, j, mj = 1 2 0 0 0.1488473E-10 1 0.2434133E-05 2 0.1621293E-05 3 0.2284486E-05 4 0.2520412E-05 5 0.1600019E-04 6 0.2236065E-05 7 0.1371671E-07 8 0.2184142E-09 9 0.0000000E+00 v, j, mj = 1 2 1 0 0.2289439E-11 1 0.5393395E-06 2 0.4462404E-05 3 0.4718862E-05 4 0.2300707E-04 5 0.8411403E-05 6 0.8911884E-07 7 0.1084053E-08 8 0.1854811E-09 9 0.0000000E+00 v, j, mj = 1 2 2 0 0.1648204E-05 1 0.1176179E-05 2 0.4590527E-05 3 0.9162825E-05 4 0.2564468E-04 5 0.6009940E-04 6 0.4933590E-05 7 0.2294226E-07 8 0.3278321E-09 9 0.0000000E+00 v, j, mj = 1 4 -4 0 0.3894584E-06 1 0.2965314E-06 2 0.1602806E-06 3 0.7937093E-06 4 0.3374671E-05 5 0.5025642E-06 6 0.3675607E-08 7 0.3685187E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -3 0 0.2398262E-12 1 0.1640167E-07 2 0.1373491E-06 3 0.1023539E-05 4 0.1154035E-05 5 0.3725901E-07 6 0.1727160E-09 7 0.2062042E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -2 0 0.3360523E-11 1 0.3676835E-06 2 0.3288817E-06 3 0.1174836E-05 4 0.5681203E-07 5 0.3582179E-06 6 0.1310022E-07 7 0.6385803E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 -1 0 0.1120513E-08 1 0.1162417E-07 2 0.6137515E-07 3 0.3323623E-07 4 0.3705355E-06 5 0.1312034E-06 6 0.2300083E-08 7 0.1326340E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 0 0 0.2846071E-11 1 0.1239030E-07 2 0.2295005E-06 3 0.2586740E-06 4 0.7948536E-06 5 0.4374271E-06 6 0.1423489E-07 7 0.9382159E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 1 0 0.1956763E-11 1 0.2714371E-06 2 0.4351996E-06 3 0.5219208E-06 4 0.3447042E-05 5 0.5696232E-06 6 0.5085264E-08 7 0.7037463E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 2 0 0.8355738E-06 1 0.1584502E-05 2 0.2543650E-05 3 0.2739005E-05 4 0.4540866E-05 5 0.1661848E-05 6 0.4928867E-07 7 0.7461520E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 3 0 0.2529501E-11 1 0.1224461E-05 2 0.7649599E-05 3 0.1721750E-04 4 0.1243974E-04 5 0.1377027E-05 6 0.1900853E-07 7 0.7781087E-09 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 4 4 0 0.4282399E-11 1 0.6038556E-07 2 0.1750530E-04 3 0.3862467E-04 4 0.1045931E-03 5 0.1291137E-04 6 0.1409839E-06 7 0.1531565E-08 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -6 0 0.2473328E-11 1 0.6653849E-08 2 0.2548261E-07 3 0.6015386E-08 4 0.1933519E-09 5 0.1131021E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -5 0 0.9860767E-12 1 0.2392540E-07 2 0.1905270E-07 3 0.2047256E-08 4 0.1740939E-09 5 0.6204049E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -4 0 0.1653154E-08 1 0.7948896E-08 2 0.1690108E-08 3 0.1819989E-08 4 0.1049529E-08 5 0.5768156E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -3 0 0.6276174E-13 1 0.1894298E-09 2 0.1410417E-08 3 0.2774576E-08 4 0.5785155E-09 5 0.3886085E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -2 0 0.2020907E-13 1 0.2149126E-09 2 0.3382514E-09 3 0.1951812E-08 4 0.1020982E-09 5 0.3871705E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 -1 0 0.1153113E-10 1 0.3534054E-10 2 0.5559409E-09 3 0.2714404E-09 4 0.8191335E-09 5 0.1117138E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 0 0 0.4825296E-13 1 0.3598922E-09 2 0.2625967E-09 3 0.2293569E-08 4 0.1249565E-08 5 0.1814881E-09 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 1 0 0.1833823E-13 1 0.1798417E-09 2 0.6254940E-09 3 0.4966812E-08 4 0.2508318E-08 5 0.1015138E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 2 0 0.2504242E-08 1 0.3467991E-08 2 0.9524176E-08 3 0.1183777E-07 4 0.7300381E-08 5 0.1964161E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 3 0 0.3977446E-13 1 0.1002467E-07 2 0.4767081E-07 3 0.9090246E-07 4 0.1040260E-07 5 0.4724180E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 4 0 0.3981796E-11 1 0.8495658E-07 2 0.2220809E-05 3 0.1923647E-05 4 0.1031881E-06 5 0.8327417E-08 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 5 0 0.4063608E-07 1 0.4164336E-05 2 0.4892776E-04 3 0.2378446E-04 4 0.1117295E-05 5 0.2611714E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 6 6 0 0.1930279E-10 1 0.1704966E-03 2 0.6107211E-03 3 0.1492083E-03 4 0.3982242E-05 5 0.4071388E-07 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 8 -8 0 0.6583112E-15 1 0.2790391E-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 0.3017892E-13 1 0.4693204E-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 0.4794975E-15 1 0.7152933E-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 0.4685069E-16 1 0.5292561E-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 0.4198921E-12 1 0.1182625E-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 -3 0 0.4370646E-17 1 0.2661689E-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 0.5290522E-17 1 0.1985905E-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 0.1786230E-12 1 0.1144330E-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 0 0 0.2107641E-17 1 0.9917017E-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 0.6592976E-17 1 0.1333277E-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 2 0 0.1684209E-11 1 0.5995796E-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 3 0 0.7987782E-17 1 0.3982258E-11 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 0.3299482E-17 1 0.6793125E-11 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 0.1527357E-09 1 0.3605681E-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 6 0 0.6337219E-15 1 0.2382566E-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 7 0 0.4973170E-15 1 0.9311790E-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 8 0 0.1426813E-06 1 0.2307007E-07 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 = 0.8064453 average vibrational energy (ev) = 0.000962 average rotational energy (ev) = 0.483208 average diffraction energy (ev) = 0.053890 the reaction probability = 0.1935547D+00 etrans(icomin)= 0.151114 etrans(icomax)= 0.548327 etrans= 0.550000 CPU TIMES Total computation 253830.6417 (a) ... Propagating the wavefunction 250699.0248 (b) Setup time 2697.4137 Saving the wave function for rerun 95.8549 Calculating averages 8.4023 Calculating and saving BK-coeffs 41.0048 Asymptotic analysis 19.8523 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 253561.5529 (a) ... FFTs along X and Y 10204.6849 Kinetic energy operation along Z 42028.0830 Kinetic energy operation along r 35564.0565 Potential energy multiplication 38072.8388 Legengre transforms 103612.1017 Shifting the wavefunction 9998.9381 Kinetic energy multiplications (xy) 1374.7578 Absorbing the wavefunction 1959.3024 Projection formalism 84.8434 Operations on specular grid 0.1800 ----------------------------------------------------- Sum 242899.7867 (b) ... Potential initialisation time 0.0001 Potential setup time 2621.7753 FFTs along X 6265.6384 FFTs along Y 3939.0465 Time spent on FGH for asympwf 0.5488 Ending date and time: Fri Aug 16 21:49:40 CEST 2019