Starting date and time: Thu Oct 31 14:17:32 CET 2019 Calculation run on nodes/processors: node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net node21.octo.wks.gorlaeus.net *** SPO-DVR program version 5.16 (Compiled using IFORT for X86 on Oct 31 2019 at 10:33:44) run on 20191031 at 141732.784 *** * 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 16 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): 0.48400000E+01 * The surface lattice constant in Y (bohr): 0.48400000E+01 * The asymptotic value in Z (bohr): 0.15000000E+02 * The cutoff value in r (bohr): 0.10000000E+04 * The unit cell skewing angle (degrees): 0.60000000E+02 * The unit cell point group: C6v 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: v0j1mj1-0.4eV-1.2eV * SystemID: H2Cu111DaiLight * 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: 192 * 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: 224 * Number of points on the scattering grid in r: 48 * 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.: 35 * Maximum Mj value in grid representation.: 27 * 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): 0.16000000E+05 * Time step used in the propagation (aut): 0.20000000E+01 * Number of time steps taken: 8000 * 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: 0.40000000E+00 * Highest energy of the initial wave packet: 0.12000000E+01 * Average position of the initial wave packet: 0.16800000E+02 * Initial rotational quantum number J: 1 * Initial rotational quantum number Mj: 1 * 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: T * Will try to find an optimal number of phis: 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): 0.18100000E+02 * Optical potential in Z absorbs optimally for (eV): 0.30000000E+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): 0.78500000E+01 * Optical potential in r absorbs optimally for (eV): 0.25000000E+00 * Using a quadratic optical potential on the specular grid in Z: * Optical potential in Z start at (bohr): 0.18800000E+02 * Optical potential in Z ends at (bohr): 0.21300000E+02 * Optical potential in Z specular absorbs optimally for (eV 0.25000000E+00 * 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: 1 * Mj in: 1 * Maximum J value in grid rep.: 35 * 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 = 36 ... * Setting up the angular grid module with JMax = 35 ... * The nearest size allowed by FFT routines ( 56 ) for phi grid will be used ... * Setting up the angular grid and basis functions... *** THE GRID PARAMETERS *** * Number of phi's : 56 * Delta value in phi coordinate : 0.112199737628207 * Number of theta's : 18 * JMax in basis set : 35 * JMin in basis set : 1 * Delta J in basis set : 2 * Grid has been set up for JIn = 1 , MjIn = 1 ... *** 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) = 0.327249 grid interval size in kz dir. (spec. grid) = 0.280499 initial momentum in z direction = 14.197463 grid interval size in kr dir. = 0.872665 grid interval size in kx dir. = 1.499008 initial momentum in reciprocal x direction = 0.000000 grid interval size in ky dir. = 1.499008 initial momentum in reciprocal y direction = 0.000000 For backward compatibility: nmoder = 4 asymptotic analysis at z = 15.200000 No flux analysis performed. nzpot = 160 optical potential in z scat.grid: nzchsp = 163 z(nzchsp)= 15.200000 optical potential in z scat.grid: nzchmx = 192 z(nzchmx)= 18.100000 optical potential in z spec.grid: nschsp = 199 z(nschsp)= 18.800000 optical potential in z spec.grid: nschmx = 224 z(nschmx)= 21.300000 optical potential in r scat.grid: nrchsp = 26 r(nrchsp)= 4.550000 optical potential in r scat.grid: nrchmx = 48 r(nrchmx)= 7.850000 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) = 0.400000 ectmax (ev) = 1.200000 Total time for potential initialisation = 0.24080276E-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 H2Cu111DaiLight PES... Number of points in Z for which the potential is calculated = 160 Number of points in r for which the potential is calculated = 48 Number of points in (x,y) for which the potential is calculated = 120 Number of points in theta for which the potential is calculated = 18 Number of points in phi for which the potential is calculated = 56 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 = 143 iz = 144 iz = 145 iz = 146 iz = 147 iz = 148 iz = 149 iz = 150 iz = 151 iz = 152 iz = 153 iz = 154 iz = 155 iz = 156 iz = 157 iz = 158 iz = 159 iz = 160 Saving H2Cu111DaiLight PES into file : ./H2Cu111DaiLight_160_-1.000_0.100_48_0.800_0.150_20_20_4.840_35_27.pes * Imposing a maximum on the potential; vmax (eV) = 0.10000000E+02 Total time setting up the potential = 0.11088944E+03 secs ******************************************************************************** INFO FROM SETTING UP THE ROVIBARIONAL ASYMPTOTIC POTENTIAL ******************************************************************************** The gas phase vibrational potential for Z = 15.0000000000000 r(Bohr) V(eV) --------------------------------------------- 0.800000000000000 -1.29276651691667 0.950000000000000 -3.10377701865572 1.10000000000000 -4.12636689687552 1.25000000000000 -4.61375300425259 1.40000000000000 -4.74566816000000 1.55000000000000 -4.64876046219645 1.70000000000000 -4.41145070381661 1.85000000000000 -4.09473693502058 2.00000000000000 -3.74003743319513 2.15000000000000 -3.37487149829848 2.30000000000000 -3.01696341727750 2.45000000000000 -2.67719795329179 2.60000000000000 -2.36174062453888 2.75000000000000 -2.07355169133745 2.90000000000000 -1.81346098089371 3.05000000000000 -1.58092543597296 3.20000000000000 -1.37455816434398 3.35000000000000 -1.19249355210690 3.50000000000000 -1.03263530956631 3.65000000000000 -0.892821399726447 3.80000000000000 -0.770930377899608 3.95000000000000 -0.664946808489691 4.10000000000000 -0.572998434182264 4.25000000000000 -0.493374149647834 4.40000000000000 -0.424529207306810 4.55000000000000 -0.365082186417763 4.70000000000000 -0.313806890927582 4.85000000000000 -0.269621361498093 5.00000000000000 -0.231575487180747 5.15000000000000 -0.198838205163101 5.30000000000000 -0.170684926563909 5.45000000000000 -0.146485581403054 5.60000000000000 -0.125693506795470 5.75000000000000 -0.107835287463201 5.90000000000000 -9.250158114192657E-002 6.05000000000000 -7.933891204381714E-002 6.20000000000000 -6.804238506364567E-002 6.35000000000000 -5.834925602088317E-002 6.50000000000000 -5.003328473224171E-002 6.65000000000000 -4.289979513435141E-002 6.80000000000000 -3.678136792885323E-002 6.95000000000000 -3.153409483714516E-002 7.10000000000000 -2.703432851734422E-002 7.25000000000000 -2.317586782330425E-002 7.40000000000000 -1.986752391619913E-002 7.55000000000000 -1.703101847680785E-002 7.70000000000000 -1.459917072808982E-002 7.85000000000000 -1.251433505809098E-002 * 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 -4.477030 -0.014815 0.1848586D-01 0.1475537D-02 1.0000000 1.4427946 0 1 -4.462214 0.000000 0.1789900D-01 0.1424805D-02 1.0000000 1.4450389 0 2 -4.432725 0.029489 0.1678050D-01 0.1328483D-02 1.0000000 1.4495097 0 3 -4.388839 0.073375 0.1523221D-01 0.1196007D-02 1.0000000 1.4561729 0 4 -4.330960 0.131254 0.1338742D-01 0.1039588D-02 1.0000000 1.4649803 0 5 -4.259603 0.202612 0.1139196D-01 0.8723799D-03 1.0000000 1.4758727 0 6 -4.175379 0.286835 0.9385476D-02 0.7066913D-03 1.0000000 1.4887836 0 7 -4.078978 0.383236 0.7486124D-02 0.5525798D-03 1.0000000 1.5036432 0 8 -3.971150 0.491065 0.5780714D-02 0.4170311D-03 1.0000000 1.5203813 0 9 -3.852687 0.609527 0.4321191D-02 0.3037626D-03 1.0000000 1.5389314 0 10 -3.724413 0.737802 0.3126699D-02 0.2135577D-03 1.0000000 1.5592327 0 11 -3.587161 0.875054 0.2189671D-02 0.1449461D-03 1.0000000 1.5812326 0 12 -3.441771 1.020443 0.1483931D-02 0.9502162D-04 1.0000000 1.6048887 0 13 -3.289076 1.173138 0.9729756D-03 0.6022029D-04 1.0000000 1.6301697 0 14 -3.129897 1.332318 0.6170688D-03 0.3694159D-04 1.0000000 1.6570573 0 15 -2.965034 1.497181 0.3784236D-03 0.2196471D-04 1.0000000 1.6855468 0 16 -2.795267 1.666948 0.2243322D-03 0.1266412D-04 1.0000000 1.7156482 0 17 -2.621352 1.840862 0.1285070D-03 0.7063067D-05 1.0000000 1.7473876 0 18 -2.444019 2.018195 0.7111284D-04 0.3776900D-05 1.0000000 1.7808088 0 19 -2.263974 2.198241 0.3800496D-04 0.1897318D-05 1.0000000 1.8159749 0 20 -2.081896 2.380319 0.1961080D-04 0.8597425D-06 1.0000000 1.8529708 0 21 -1.898443 2.563772 0.9766609D-05 0.3235054D-06 1.0000000 1.8919070 0 22 -1.714251 2.747964 0.4690267D-05 0.8115323D-07 1.0000000 1.9329238 0 23 -1.529938 2.932277 0.2167615D-05 0.8210360D-09 1.0000000 1.9761974 0 24 -1.346107 3.116107 0.9603085D-06 -0.3801870D-08 1.0000000 2.0219489 0 25 -1.163350 3.298865 0.4053078D-06 0.1361482D-07 1.0000000 2.0704559 0 26 -0.982252 3.479962 0.1617050D-06 0.2574427D-07 1.0000000 2.1220703 0 27 -0.803400 3.658814 0.6064207D-07 0.2515729D-07 1.0000000 2.1772432 0 28 -0.627387 3.834827 0.2150481D-07 0.1598314D-07 1.0000000 2.2365642 0 29 -0.454827 4.007388 0.7456608D-08 0.5567063D-08 1.0000000 2.3008226 0 30 -0.286364 4.175850 0.2690772D-08 -0.1136768D-08 1.0000000 2.3711115 0 31 -0.122703 4.339511 -0.1039650D-08 0.3209770D-08 1.0000000 2.4490129 0 32 0.035361 4.497575 -0.4021495D-09 0.2179053D-08 1.0000000 2.5369656 0 33 0.186873 4.649087 0.1106458D-08 0.2924488D-07 1.0000000 2.6390968 0 34 0.330576 4.792790 0.6244403D-06 0.1979023D-04 1.0000000 2.7635772 0 35 0.379995 4.842209 0.8985617D-02 0.2992250D+00 1.0000000 7.0927533 1 0 -3.963235 0.498979 0.5132066D-01 0.4807261D-02 1.0000000 1.5326456 1 1 -3.949006 0.513208 0.4976106D-01 0.4648362D-02 1.0000000 1.5350897 1 2 -3.920695 0.541520 0.4677990D-01 0.4345810D-02 1.0000000 1.5399582 1 3 -3.878587 0.583627 0.4263372D-01 0.3927765D-02 1.0000000 1.5472126 1 4 -3.823100 0.639115 0.3766212D-01 0.3431092D-02 1.0000000 1.5567992 1 5 -3.754762 0.707453 0.3224281D-01 0.2896129D-02 1.0000000 1.5686528 1 6 -3.674198 0.788016 0.2674526D-01 0.2361412D-02 1.0000000 1.5827008 1 7 -3.582110 0.880104 0.2149067D-01 0.1859312D-02 1.0000000 1.5988683 1 8 -3.479257 0.982957 0.1672402D-01 0.1413235D-02 1.0000000 1.6170823 1 9 -3.366436 1.095779 0.1260123D-01 0.1036627D-02 1.0000000 1.6372753 1 10 -3.244469 1.217746 0.9190817D-02 0.7336296D-03 1.0000000 1.6593887 1 11 -3.114188 1.348026 0.6486967D-02 0.5009139D-03 1.0000000 1.6833754 1 12 -2.976426 1.485789 0.4429334D-02 0.3300890D-03 1.0000000 1.7092016 1 13 -2.832005 1.630209 0.2924742D-02 0.2101382D-03 1.0000000 1.7368486 1 14 -2.681733 1.780482 0.1866850D-02 0.1294759D-03 1.0000000 1.7663144 1 15 -2.526397 1.935818 0.1151336D-02 0.7742025D-04 1.0000000 1.7976153 1 16 -2.366762 2.095453 0.6857201D-03 0.4504908D-04 1.0000000 1.8307872 1 17 -2.203569 2.258645 0.3942077D-03 0.2551848D-04 1.0000000 1.8658880 1 18 -2.037535 2.424680 0.2186467D-03 0.1398247D-04 1.0000000 1.9030006 1 19 -1.869352 2.592862 0.1169657D-03 0.7265280D-05 1.0000000 1.9422360 1 20 -1.699691 2.762523 0.6033803D-04 0.3426415D-05 1.0000000 1.9837387 1 21 -1.529203 2.933011 0.3001001D-04 0.1332359D-05 1.0000000 2.0276931 1 22 -1.358522 3.103692 0.1438264D-04 0.3126372D-06 1.0000000 2.0743332 1 23 -1.188268 3.273946 0.6630402D-05 -0.6477473D-07 1.0000000 2.1239555 1 24 -1.019055 3.443159 0.2928020D-05 -0.1052599D-06 1.0000000 2.1769381 1 25 -0.851494 3.610721 -0.1229309D-05 0.2280329D-07 1.0000000 2.2337687 1 26 -0.686200 3.776015 0.4853794D-06 0.5567670D-07 1.0000000 2.2950870 1 27 -0.523806 3.938408 0.1782675D-06 0.8227786D-07 1.0000000 2.3617527 1 28 -0.364977 4.097237 0.6084680D-07 0.6392419D-07 1.0000000 2.4349580 1 29 -0.210429 4.251785 0.1990624D-07 0.2941816D-07 1.0000000 2.5164293 1 30 -0.060968 4.401247 -0.6744530D-08 -0.2486794D-08 1.0000000 2.6088185 1 31 0.082449 4.544663 -0.1999446D-08 0.2229379D-07 1.0000000 2.7165670 1 32 0.218580 4.680795 0.5934791D-07 0.1735311D-05 1.0000000 2.8482092 1 33 0.338602 4.800816 0.9323001D-02 0.2777787D+00 1.0000000 7.0406615 1 34 0.359083 4.821297 0.9158667D-02 0.2887111D+00 1.0000000 7.0683539 1 35 0.461461 4.923675 0.9215371D-02 0.3022111D+00 1.0000000 6.4310540 2 0 -3.480763 0.981452 0.1023433D+00 0.1125496D-01 1.0000000 1.6293736 2 1 -3.467153 0.995062 0.9938070D-01 0.1089906D-01 1.0000000 1.6320389 2 2 -3.440083 1.022131 0.9369881D-01 0.1021923D-01 1.0000000 1.6373484 2 3 -3.399849 1.062365 0.8575390D-01 0.9274954D-02 1.0000000 1.6452614 2 4 -3.346877 1.115338 0.7615904D-01 0.8145234D-02 1.0000000 1.6557205 2 5 -3.281706 1.180508 0.6560996D-01 0.6918134D-02 1.0000000 1.6686562 2 6 -3.204974 1.257241 0.5480444D-01 0.5679823D-02 1.0000000 1.6839915 2 7 -3.117388 1.344827 0.4436795D-01 0.4504908D-02 1.0000000 1.7016483 2 8 -3.019712 1.442502 0.3479680D-01 0.3449620D-02 1.0000000 1.7215522 2 9 -2.912746 1.549468 0.2642625D-01 0.2548670D-02 1.0000000 1.7436375 2 10 -2.797309 1.664906 0.1942528D-01 0.1815739D-02 1.0000000 1.7678509 2 11 -2.674226 1.787989 0.1381465D-01 0.1246816D-02 1.0000000 1.7941543 2 12 -2.544319 1.917896 0.9500543D-02 0.8251808D-03 1.0000000 1.8225275 2 13 -2.408399 2.053815 0.6314929D-02 0.5267873D-03 1.0000000 1.8529705 2 14 -2.267261 2.194954 0.4054622D-02 0.3250829D-03 1.0000000 1.8855059 2 15 -2.121677 2.340537 0.2513125D-02 0.1946915D-03 1.0000000 1.9201808 2 16 -1.972399 2.489816 0.1502641D-02 0.1137774D-03 1.0000000 1.9570697 2 17 -1.820153 2.642061 0.8660883D-03 0.6517626D-04 1.0000000 1.9962781 2 18 -1.665646 2.796569 0.4808987D-03 0.3652640D-04 1.0000000 2.0379475 2 19 -1.509561 2.952654 0.2571146D-03 0.1969197D-04 1.0000000 2.0822627 2 20 -1.352563 3.109651 0.1323420D-03 0.9785595D-05 1.0000000 2.1294617 2 21 -1.195303 3.266911 0.6558123D-04 0.4082839D-05 1.0000000 2.1798484 2 22 -1.038422 3.423793 0.3128278D-04 0.1074228D-05 1.0000000 2.2338130 2 23 -0.882552 3.579662 0.1434495D-04 -0.1909329D-06 1.0000000 2.2918596 2 24 -0.728332 3.733882 0.6297676D-05 -0.4345611D-06 1.0000000 2.3546496 2 25 -0.576411 3.885804 -0.2624300D-05 0.2303132D-06 1.0000000 2.4230697 2 26 -0.427463 4.034752 0.1023826D-05 0.3027801D-07 1.0000000 2.4983430 2 27 -0.282210 4.180004 0.3678875D-06 0.1641295D-06 1.0000000 2.5822236 2 28 -0.141451 4.320763 0.1206725D-06 0.1591278D-06 1.0000000 2.6773657 2 29 -0.006116 4.456098 0.3736072D-07 0.9581881D-07 1.0000000 2.7881011 2 30 0.122624 4.584838 0.3250488D-07 0.5579099D-06 1.0000000 2.9223712 2 31 0.243107 4.705321 0.2688707D-05 0.7187609D-04 1.0000000 3.0980984 2 32 0.318536 4.780751 0.9472110D-02 0.2663148D+00 1.0000000 7.0090819 2 33 0.345561 4.807775 0.9602960D-04 0.2857377D-02 1.0000000 3.0255628 2 34 0.435354 4.897568 0.9230146D-02 0.2867812D+00 1.0000000 6.3727041 2 35 0.464525 4.926740 0.8227285D-03 0.2696518D-01 1.0000000 2.9570418 energy initial v,j state = -4.462214 potential energy = -4.609228 rotational energy = 0.014792 vibrational energy = 0.132222 rovibrational energy = 0.147014 expectation value r = 1.445039 ******************************************************************************** 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 ******************************************************************************** 626 rotation channels in basis (nrotw) * number of rotational states analysed, nana = 78 * initial rotational state in basis, ichn = 323 ******************************************************************************** INFO FROM SETTING UP THE ROTATION-DIFFRACTION BASIS ******************************************************************************** ***** rotation-diffraction channels in basis (nstatw) * Number of rotation-diffraction analysed, nstata = 21138 * Index of initial rot-dif channel in basis, inchna = 11383 ******************************************************************************** INFO FROM SETTING UP THE OPTICAL POTENTIALS ******************************************************************************** * Optical potential in Z absorbs with coefficient: 0.20911695E-01 * Optical potential in r absorbs with coefficient: 0.22683430E-01 * Optical potential in Z specular absorbs with coefficient: 0.19795027E-01 ******************************************************************************** INFO FROM SETTING UP THE GRID ENERGIES ******************************************************************************** * Maximum diffraction order included on the momentum grid = 9 * Number of diffraction channels included = 271 * Number of diffraction channels excluded = 129 * 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 0.40916326E-06 - at the end/beginning of the grid 0.58046226E-09 - maximum value = 0.45760249E+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 = 198 * 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 16.80000000 1.44503885 0.10000000E+01 0.50000000E+02 0.99999901 16.60679608 1.44504564 0.99999889E+00 0.10000000E+03 0.99999799 16.41359217 1.44505168 0.99999173E+00 0.15000000E+03 0.99999698 16.22038825 1.44505165 0.99981147E+00 0.20000000E+03 0.99999596 16.02718434 1.44505087 0.99715220E+00 0.25000000E+03 0.99999495 15.83398044 1.44504904 0.97739773E+00 0.30000000E+03 0.99999393 15.64077671 1.44504280 0.90071458E+00 0.35000000E+03 0.99999291 15.44757405 1.44503941 0.73282259E+00 0.40000000E+03 0.99999190 15.25437498 1.44504784 0.50522034E+00 0.45000000E+03 0.99999088 15.06118353 1.44505281 0.29477619E+00 0.50000000E+03 0.99998987 14.86800313 1.44505092 0.14944546E+00 0.55000000E+03 0.99998885 14.67483494 1.44504924 0.68289190E-01 0.60000000E+03 0.99998783 14.48167820 1.44504627 0.29155786E-01 0.65000000E+03 0.99998681 14.28853160 1.44504036 0.11992149E-01 0.70000000E+03 0.99998579 14.09539426 1.44503957 0.48675428E-02 0.75000000E+03 0.99998477 13.90226599 1.44504894 0.19848307E-02 ==> ZAnalysis on specular channel fixed at Z = 0.17100000E+02 0.80000000E+03 0.99998376 13.70914716 1.44505275 0.82347008E-03 0.85000000E+03 0.99998274 13.51603852 1.44504917 0.35060227E-03 0.90000000E+03 0.99998172 13.32294113 1.44504733 0.15403109E-03 0.95000000E+03 0.99998070 13.12985625 1.44504389 0.70051823E-04 0.10000000E+04 0.99997967 12.93678536 1.44503911 0.33031107E-04 0.10500000E+04 0.99997865 12.74373014 1.44504091 0.16154368E-04 0.11000000E+04 0.99997762 12.55069246 1.44505055 0.81910044E-05 0.11500000E+04 0.99997660 12.35767447 1.44505268 0.43016803E-05 0.12000000E+04 0.99997557 12.16467857 1.44504771 0.23367309E-05 0.12500000E+04 0.99997454 11.97170747 1.44504632 0.13109030E-05 0.13000000E+04 0.99997351 11.77876422 1.44504307 0.75821188E-06 0.13500000E+04 0.99997248 11.58585229 1.44504043 0.45134376E-06 0.14000000E+04 0.99997144 11.39297555 1.44504525 0.27603143E-06 0.14500000E+04 0.99997040 11.20013840 1.44505554 0.17314373E-06 0.15000000E+04 0.99996936 11.00734581 1.44505708 0.11121372E-06 0.15500000E+04 0.99996831 10.81460341 1.44505304 0.73040621E-07 0.16000000E+04 0.99996726 10.62191755 1.44505470 0.48979809E-07 0.16500000E+04 0.99996620 10.42929545 1.44505542 0.33491658E-07 0.17000000E+04 0.99996514 10.23674528 1.44505935 0.23322762E-07 0.17500000E+04 0.99996407 10.04427633 1.44507231 0.16520678E-07 0.18000000E+04 0.99996299 9.85189915 1.44508993 0.11890638E-07 0.18500000E+04 0.99996190 9.65962575 1.44510029 0.86872767E-08 0.19000000E+04 0.99996081 9.46746982 1.44511040 0.64365496E-08 0.19500000E+04 0.99995970 9.27544699 1.44513201 0.48324589E-08 0.20000000E+04 0.99995858 9.08357512 1.44515902 0.36737399E-08 0.20500000E+04 0.99995744 8.89187471 1.44519809 0.28258615E-08 0.21000000E+04 0.99995630 8.70036926 1.44525670 0.21979387E-08 0.21500000E+04 0.99995513 8.50908589 1.44533081 0.17276075E-08 0.22000000E+04 0.99995394 8.31805589 1.44541603 0.13714589E-08 0.22500000E+04 0.99995273 8.12731557 1.44552785 0.10989621E-08 0.23000000E+04 0.99995148 7.93690715 1.44568458 0.88837322E-09 0.23500000E+04 0.99995022 7.74688000 1.44589026 0.72408273E-09 0.24000000E+04 0.99994892 7.55729209 1.44616564 0.59482677E-09 0.24500000E+04 0.99994759 7.36821173 1.44653618 0.49232264E-09 0.25000000E+04 0.99994622 7.17971978 1.44701984 0.41034138E-09 0.25500000E+04 0.99994482 6.99191223 1.44764873 0.34421542E-09 0.26000000E+04 0.99994337 6.80490313 1.44848152 0.29050240E-09 0.26500000E+04 0.99994188 6.61882801 1.44958982 0.24664204E-09 0.27000000E+04 0.99994033 6.43384736 1.45104632 0.21065200E-09 0.27500000E+04 0.99993868 6.25015035 1.45295754 0.18091343E-09 0.28000000E+04 0.99993683 6.06795823 1.45545438 0.15615473E-09 0.28500000E+04 0.99993456 5.88752735 1.45867952 0.13539425E-09 0.29000000E+04 0.99993138 5.70915137 1.46281445 0.11790965E-09 0.29500000E+04 0.99992635 5.53316232 1.46808037 0.10315650E-09 0.30000000E+04 0.99991774 5.35993031 1.47472192 0.90671876E-10 0.30500000E+04 0.99990247 5.18986156 1.48298886 0.80060269E-10 0.31000000E+04 0.99987548 5.02339456 1.49315222 0.70982659E-10 0.31500000E+04 0.99982872 4.86099429 1.50548231 0.63155134E-10 0.32000000E+04 0.99975007 4.70314455 1.52021877 0.56364874E-10 0.32500000E+04 0.99962200 4.55033835 1.53757443 0.50458063E-10 0.33000000E+04 0.99942025 4.40306673 1.55771517 0.45314071E-10 0.33500000E+04 0.99911252 4.26180654 1.58072879 0.40832513E-10 0.34000000E+04 0.99865751 4.12700752 1.60660218 0.36924914E-10 0.34500000E+04 0.99800433 3.99907984 1.63522362 0.33507284E-10 0.35000000E+04 0.99709263 3.87838297 1.66637277 0.30500971E-10 0.35500000E+04 0.99585334 3.76521689 1.69970965 0.27838479E-10 0.36000000E+04 0.99421046 3.65981630 1.73479346 0.25466079E-10 0.36500000E+04 0.99208365 3.56234841 1.77109646 0.23342471E-10 0.37000000E+04 0.98939151 3.47291501 1.80801505 0.21436468E-10 0.37500000E+04 0.98605533 3.39155824 1.84489796 0.19724575E-10 0.38000000E+04 0.98200337 3.31826884 1.88109406 0.18187996E-10 0.38500000E+04 0.97717507 3.25299604 1.91600248 0.16809856E-10 0.39000000E+04 0.97152476 3.19565736 1.94911262 0.15573729E-10 0.39500000E+04 0.96502476 3.14614695 1.98003084 0.14463448E-10 0.40000000E+04 0.95766761 3.10434158 2.00846146 0.13462752E-10 0.40500000E+04 0.94946744 3.07010508 2.03414702 0.12555964E-10 0.41000000E+04 0.94045998 3.04329304 2.05680464 0.11733770E-10 0.41500000E+04 0.93070129 3.02375887 2.07609176 0.10989727E-10 0.42000000E+04 0.92026566 3.01136121 2.09162184 0.10296876E-10 0.42500000E+04 0.90924273 3.00597198 2.10302718 0.96407757E-11 0.43000000E+04 0.89773387 3.00748361 2.11004903 0.90721638E-11 0.43500000E+04 0.88584827 3.01581323 2.11260598 0.85721999E-11 0.44000000E+04 0.87369913 3.03090251 2.11080642 0.80330912E-11 0.44500000E+04 0.86140034 3.05271282 2.10490557 0.74957707E-11 0.45000000E+04 0.84906353 3.08121711 2.09522823 0.72169632E-11 0.45500000E+04 0.83679564 3.11639038 2.08209178 0.70277081E-11 0.46000000E+04 0.82469703 3.15820034 2.06576783 0.62766590E-11 0.46500000E+04 0.81285988 3.20659982 2.04650594 0.70597680E-11 0.47000000E+04 0.80136678 3.26152190 2.02459740 0.79739134E-11 0.47500000E+04 0.79028940 3.32287715 2.00042925 0.85794050E-11 0.48000000E+04 0.77968798 3.39055120 1.97449162 0.15904014E-10 0.48500000E+04 0.76961150 3.46440184 1.94733455 0.20630356E-10 0.49000000E+04 0.76009789 3.54425664 1.91949906 0.37837851E-10 0.49500000E+04 0.75117392 3.62991227 1.89145584 0.60902213E-10 0.50000000E+04 0.74285527 3.72113493 1.86358003 0.97446933E-10 0.50500000E+04 0.73514769 3.81766058 1.83616540 0.16352752E-09 0.51000000E+04 0.72804873 3.91919589 1.80945196 0.24776524E-09 0.51500000E+04 0.72154900 4.02542349 1.78363627 0.39668167E-09 0.52000000E+04 0.71563181 4.13601403 1.75886235 0.57520094E-09 0.52500000E+04 0.71027248 4.25064242 1.73522231 0.84596624E-09 0.53000000E+04 0.70543864 4.36900132 1.71278201 0.11373273E-08 0.53500000E+04 0.70109266 4.49080614 1.69160754 0.14870233E-08 0.54000000E+04 0.69719508 4.61579216 1.67176714 0.17847627E-08 0.54500000E+04 0.69370757 4.74370827 1.65332560 0.20087181E-08 0.55000000E+04 0.69059455 4.87431203 1.63635098 0.21133357E-08 0.55500000E+04 0.68782316 5.00736832 1.62089905 0.21373788E-08 0.56000000E+04 0.68536233 5.14265269 1.60694640 0.24119566E-08 0.56500000E+04 0.68318162 5.27995841 1.59434321 0.35637340E-08 0.57000000E+04 0.68125073 5.41910339 1.58287289 0.67253281E-08 0.57500000E+04 0.67954019 5.55993254 1.57237332 0.13905391E-07 0.58000000E+04 0.67802255 5.70231428 1.56279856 0.27215315E-07 0.58500000E+04 0.67667330 5.84613430 1.55417842 0.49676329E-07 0.59000000E+04 0.67547080 5.99129101 1.54652741 0.83860669E-07 0.59500000E+04 0.67439551 6.13769535 1.53977380 0.13091746E-06 0.60000000E+04 0.67342902 6.28527338 1.53376027 0.19103056E-06 0.60500000E+04 0.67255372 6.43396715 1.52832176 0.26012235E-06 0.61000000E+04 0.67175335 6.58373069 1.52336357 0.33101298E-06 0.61500000E+04 0.67101393 6.73452144 1.51885896 0.39461826E-06 0.62000000E+04 0.67032445 6.88629073 1.51479879 0.44057040E-06 0.62500000E+04 0.66967689 7.03897769 1.51116349 0.46454256E-06 0.63000000E+04 0.66906534 7.19250952 1.50790648 0.47749489E-06 0.63500000E+04 0.66848461 7.34680789 1.50493860 0.51717379E-06 0.64000000E+04 0.66792886 7.50179834 1.50216301 0.66299794E-06 0.64500000E+04 0.66739078 7.65741805 1.49955015 0.10529793E-05 0.65000000E+04 0.66686159 7.81361820 1.49714628 0.19011163E-05 0.65500000E+04 0.66633163 7.97035930 1.49498021 0.35089000E-05 0.66000000E+04 0.66579143 8.12760060 1.49298233 0.62751068E-05 0.66500000E+04 0.66523261 8.28528702 1.49101163 0.10694776E-04 0.67000000E+04 0.66464837 8.44333799 1.48895112 0.17331769E-04 0.67500000E+04 0.66403344 8.60164185 1.48678774 0.26793576E-04 0.68000000E+04 0.66338341 8.76005718 1.48462673 0.39717462E-04 0.68500000E+04 0.66269377 8.91842018 1.48262084 0.56732563E-04 0.69000000E+04 0.66195884 9.07655532 1.48085280 0.78390229E-04 0.69500000E+04 0.66117090 9.23428593 1.47926712 0.10501641E-03 0.70000000E+04 0.66031965 9.39144189 1.47771949 0.13641336E-03 0.70500000E+04 0.65939216 9.54786321 1.47610824 0.17151912E-03 0.71000000E+04 0.65837306 9.70340003 1.47447525 0.20828655E-03 0.71500000E+04 0.65724496 9.85791109 1.47298187 0.24386697E-03 0.72000000E+04 0.65598895 10.01126249 1.47177221 0.27494756E-03 0.72500000E+04 0.65458495 10.16332734 1.47084398 0.29819882E-03 0.73000000E+04 0.65301201 10.31398560 1.47003997 0.31093920E-03 0.73500000E+04 0.65124835 10.46312262 1.46916208 0.31186118E-03 0.74000000E+04 0.64927133 10.61062592 1.46812105 0.30135910E-03 0.74500000E+04 0.64705712 10.75638090 1.46701140 0.28121952E-03 0.75000000E+04 0.64458048 10.90026675 1.46603618 0.25394599E-03 0.75500000E+04 0.64181455 11.04215393 1.46532600 0.22221815E-03 0.76000000E+04 0.63873095 11.18190417 1.46481478 0.18865444E-03 0.76500000E+04 0.63530008 11.31937273 1.46428793 0.15560687E-03 0.77000000E+04 0.63149163 11.45441226 1.46355147 0.12489873E-03 0.77500000E+04 0.62727531 11.58687713 1.46258402 0.97879028E-04 0.78000000E+04 0.62262152 11.71662764 1.46156480 0.75966840E-04 0.78500000E+04 0.61750190 11.84353314 1.46074297 0.61270655E-04 0.79000000E+04 0.61188983 11.96747348 1.46023232 0.56775509E-04 0.79500000E+04 0.60576058 12.08833885 1.45991127 0.66033967E-04 0.80000000E+04 0.59909155 12.20602893 1.45952534 0.92693730E-04 0.80500000E+04 0.59186251 12.32045302 1.45889528 0.14010922E-03 0.81000000E+04 0.58405609 12.43153241 1.45806033 0.21085712E-03 0.81500000E+04 0.57565867 12.53920471 1.45725821 0.30582238E-03 0.82000000E+04 0.56666133 12.64342870 1.45674759 0.42302564E-03 0.82500000E+04 0.55706104 12.74418823 1.45659394 0.55709260E-03 0.83000000E+04 0.54686188 12.84149484 1.45660373 0.70013945E-03 0.83500000E+04 0.53607597 12.93538903 1.45647534 0.84368698E-03 0.84000000E+04 0.52472400 13.02594009 1.45603507 0.98032032E-03 0.84500000E+04 0.51283483 13.11324285 1.45537316 0.11040860E-02 0.85000000E+04 0.50044394 13.19741036 1.45478958 0.12097656E-02 0.85500000E+04 0.48759113 13.27856258 1.45457620 0.12922107E-02 0.86000000E+04 0.47431786 13.35681381 1.45478211 0.13467744E-02 0.86500000E+04 0.46066518 13.43226200 1.45515915 0.13706376E-02 0.87000000E+04 0.44667271 13.50498259 1.45534293 0.13640202E-02 0.87500000E+04 0.43237878 13.57502747 1.45511577 0.13305123E-02 0.88000000E+04 0.41782161 13.64242876 1.45455674 0.12763169E-02 0.88500000E+04 0.40304107 13.70720617 1.45398621 0.12089234E-02 0.89000000E+04 0.38808044 13.76937648 1.45373444 0.11362582E-02 0.89500000E+04 0.37298772 13.82896265 1.45389591 0.10668207E-02 0.90000000E+04 0.35781581 13.88600024 1.45427745 0.10102685E-02 0.90500000E+04 0.34262162 13.94053950 1.45457714 0.97764839E-03 0.91000000E+04 0.32746438 13.99264394 1.45461864 0.98073166E-03 0.91500000E+04 0.31240386 14.04238808 1.45445741 0.10302913E-02 0.92000000E+04 0.29749869 14.08985713 1.45429539 0.11339817E-02 0.92500000E+04 0.28280497 14.13514853 1.45426030 0.12950234E-02 0.93000000E+04 0.26837504 14.17837289 1.45425023 0.15122982E-02 0.93500000E+04 0.25425631 14.21965178 1.45404864 0.17812879E-02 0.94000000E+04 0.24049051 14.25911192 1.45362293 0.20948515E-02 0.94500000E+04 0.22711356 14.29687899 1.45326764 0.24437208E-02 0.95000000E+04 0.21415610 14.33307534 1.45340545 0.28171877E-02 0.95500000E+04 0.20164440 14.36782476 1.45418876 0.32038651E-02 0.96000000E+04 0.18960121 14.40126429 1.45522009 0.35918191E-02 0.96500000E+04 0.17804589 14.43355845 1.45570637 0.39678704E-02 0.97000000E+04 0.16699398 14.46490959 1.45508412 0.43171585E-02 0.97500000E+04 0.15645638 14.49555900 1.45362030 0.46240653E-02 0.98000000E+04 0.14643864 14.52577850 1.45234411 0.48741497E-02 0.98500000E+04 0.13694102 14.55585699 1.45227441 0.50559216E-02 0.99000000E+04 0.12795909 14.58608803 1.45358310 0.51618246E-02 0.99500000E+04 0.11948468 14.61676171 1.45536963 0.51885563E-02 0.10000000E+05 0.11150664 14.64815917 1.45627634 0.51369326E-02 0.10050000E+05 0.10401139 14.68054617 1.45557139 0.50113012E-02 0.10100000E+05 0.09698316 14.71416326 1.45382540 0.48189649E-02 0.10150000E+05 0.09040424 14.74921311 1.45249607 0.45701364E-02 0.10200000E+05 0.08425519 14.78584669 1.45270773 0.42777885E-02 0.10250000E+05 0.07851519 14.82414973 1.45428183 0.39565574E-02 0.10300000E+05 0.07316225 14.86413012 1.45584844 0.36212554E-02 0.10350000E+05 0.06817355 14.90570779 1.45599363 0.32859539E-02 0.10400000E+05 0.06352591 14.94871053 1.45455010 0.29633028E-02 0.10450000E+05 0.05919630 14.99287800 1.45286030 0.26635874E-02 0.10500000E+05 0.05516236 15.03787134 1.45262310 0.23941324E-02 0.10550000E+05 0.05140255 15.08328021 1.45429540 0.21593418E-02 0.10600000E+05 0.04789593 15.12861934 1.45653773 0.19608586E-02 0.10650000E+05 0.04462190 15.17331485 1.45729494 0.17977854E-02 0.10700000E+05 0.04156011 15.21669206 1.45566303 0.16674789E-02 0.10750000E+05 0.03869113 15.25798227 1.45290786 0.15670317E-02 0.10800000E+05 0.03599738 15.29636203 1.45154560 0.14947619E-02 0.10850000E+05 0.03346420 15.33102666 1.45311783 0.14506912E-02 0.10900000E+05 0.03108032 15.36128710 1.45668645 0.14354618E-02 0.10950000E+05 0.02883768 15.38666889 1.45948377 0.14481926E-02 0.11000000E+05 0.02673062 15.40698944 1.45920378 0.14846920E-02 0.11050000E+05 0.02475503 15.42239496 1.45605883 0.15373503E-02 0.11100000E+05 0.02290779 15.43335325 1.45282862 0.15968972E-02 0.11150000E+05 0.02118661 15.44061378 1.45262040 0.16552236E-02 0.11200000E+05 0.01959010 15.44515227 1.45611954 0.17080164E-02 0.11250000E+05 0.01811758 15.44810933 1.46079967 0.17559791E-02 0.11300000E+05 0.01676842 15.45072192 1.46289385 0.18035992E-02 0.11350000E+05 0.01554091 15.45424502 1.46054902 0.18554265E-02 0.11400000E+05 0.01443115 15.45986977 1.45562287 0.19121389E-02 0.11450000E+05 0.01343246 15.46865479 1.45249739 0.19692482E-02 0.11500000E+05 0.01253560 15.48148620 1.45449055 0.20190651E-02 0.11550000E+05 0.01172978 15.49906942 1.46074454 0.20543254E-02 0.11600000E+05 0.01100409 15.52194510 1.46651857 0.20715506E-02 0.11650000E+05 0.01034888 15.55051968 1.46688608 0.20728553E-02 0.11700000E+05 0.00975665 15.58510255 1.46087776 0.20652438E-02 0.11750000E+05 0.00922216 15.62593966 1.45272163 0.20572364E-02 0.11800000E+05 0.00874190 15.67322600 1.44892231 0.20543172E-02 0.11850000E+05 0.00831303 15.72707472 1.45309966 0.20559616E-02 0.11900000E+05 0.00793231 15.78743229 1.46266258 0.20562547E-02 0.11950000E+05 0.00759526 15.85395779 1.47034048 0.20474363E-02 0.12000000E+05 0.00729598 15.92591423 1.46969399 0.20239928E-02 0.12050000E+05 0.00702752 16.00212672 1.46044038 0.19851327E-02 0.12100000E+05 0.00678269 16.08104306 1.44921596 0.19345757E-02 0.12150000E+05 0.00655495 16.16090035 1.44460811 0.18782905E-02 0.12200000E+05 0.00633919 16.23997378 1.45025584 0.18216924E-02 0.12250000E+05 0.00613212 16.31686173 1.46184287 0.17676588E-02 0.12300000E+05 0.00593230 16.39074078 1.47037731 0.17161414E-02 0.12350000E+05 0.00573979 16.46150869 1.46904995 0.16651573E-02 0.12400000E+05 0.00555555 16.52974133 1.45861285 0.16124788E-02 0.12450000E+05 0.00538068 16.59644072 1.44706476 0.15571811E-02 0.12500000E+05 0.00521566 16.66263437 1.44331142 0.14999705E-02 0.12550000E+05 0.00505996 16.72896094 1.44989612 0.14420774E-02 0.12600000E+05 0.00491184 16.79539487 1.46116001 0.13838977E-02 0.12650000E+05 0.00476870 16.86121258 1.46803774 0.13248161E-02 0.12700000E+05 0.00462762 16.92520614 1.46516758 0.12642151E-02 0.12750000E+05 0.00448606 16.98605737 1.45499861 0.12023381E-02 0.12800000E+05 0.00434249 17.04273581 1.44577323 0.11403079E-02 0.12850000E+05 0.00419667 17.09478819 1.44465342 0.10798166E-02 0.12900000E+05 0.00404956 17.14242998 1.45186699 0.10227406E-02 0.12950000E+05 0.00390282 17.18641807 1.46096737 0.97039927E-03 0.13000000E+05 0.00375818 17.22776258 1.46439008 0.92271157E-03 0.13050000E+05 0.00361690 17.26739758 1.45946920 0.87803049E-03 0.13100000E+05 0.00347949 17.30594087 1.45055085 0.83400374E-03 0.13150000E+05 0.00334581 17.34361820 1.44533799 0.78881207E-03 0.13200000E+05 0.00321532 17.38033809 1.44802275 0.74192295E-03 0.13250000E+05 0.00308740 17.41583433 1.45565195 0.69423548E-03 0.13300000E+05 0.00296157 17.44978915 1.46117687 0.64780845E-03 0.13350000E+05 0.00283753 17.48189899 1.45973123 0.60505586E-03 0.13400000E+05 0.00271522 17.51189973 1.45266204 0.56753377E-03 0.13450000E+05 0.00259473 17.53959026 1.44649792 0.53502413E-03 0.13500000E+05 0.00247633 17.56487868 1.44718461 0.50568536E-03 0.13550000E+05 0.00236042 17.58784268 1.45412866 0.47718359E-03 0.13600000E+05 0.00224753 17.60876966 1.46052300 0.44792143E-03 0.13650000E+05 0.00213820 17.62813940 1.46012788 0.41763269E-03 0.13700000E+05 0.00203289 17.64653284 1.45331452 0.38724571E-03 0.13750000E+05 0.00193188 17.66448372 1.44669894 0.35831015E-03 0.13800000E+05 0.00183519 17.68232212 1.44706891 0.33230948E-03 0.13850000E+05 0.00174256 17.70006953 1.45458253 0.30999140E-03 0.13900000E+05 0.00165357 17.71742751 1.46184775 0.29090408E-03 0.13950000E+05 0.00156772 17.73386815 1.46135322 0.27354782E-03 0.14000000E+05 0.00148464 17.74880565 1.45362107 0.25626517E-03 0.14050000E+05 0.00140418 17.76180607 1.44651342 0.23829099E-03 0.14100000E+05 0.00132648 17.77277358 1.44710727 0.22013016E-03 0.14150000E+05 0.00125188 17.78204113 1.45507049 0.20298480E-03 0.14200000E+05 0.00118083 17.79030659 1.46286301 0.18777832E-03 0.14250000E+05 0.00111364 17.79840235 1.46247138 0.17460516E-03 0.14300000E+05 0.00105036 17.80696346 1.45385036 0.16291158E-03 0.14350000E+05 0.00099070 17.81613342 1.44587598 0.15202641E-03 0.14400000E+05 0.00093415 17.82546148 1.44680018 0.14153232E-03 0.14450000E+05 0.00088015 17.83407097 1.45531776 0.13131222E-03 0.14500000E+05 0.00082833 17.84104632 1.46276883 0.12143777E-03 0.14550000E+05 0.00077861 17.84586496 1.46216922 0.11208607E-03 0.14600000E+05 0.00073118 17.84865808 1.45419858 0.10349122E-03 0.14650000E+05 0.00068631 17.85015456 1.44656843 0.95839254E-04 0.14700000E+05 0.00064423 17.85132214 1.44714792 0.89098748E-04 0.14750000E+05 0.00060489 17.85289052 1.45547984 0.82961083E-04 0.14800000E+05 0.00056808 17.85501634 1.46270634 0.77047754E-04 0.14850000E+05 0.00053342 17.85726622 1.46162804 0.71216603E-04 0.14900000E+05 0.00050059 17.85889579 1.45433901 0.65624413E-04 0.14950000E+05 0.00046938 17.85923875 1.44862355 0.60505122E-04 0.15000000E+05 0.00043974 17.85800575 1.44975320 0.55948683E-04 0.15050000E+05 0.00041172 17.85538845 1.45654119 0.51890054E-04 0.15100000E+05 0.00038540 17.85195782 1.46269652 0.48212467E-04 0.15150000E+05 0.00036080 17.84840285 1.46222928 0.44800065E-04 0.15200000E+05 0.00033785 17.84521050 1.45577389 0.41538731E-04 0.15250000E+05 0.00031638 17.84243030 1.45072465 0.38347928E-04 0.15300000E+05 0.00029620 17.83964948 1.45294952 0.35248557E-04 0.15350000E+05 0.00027714 17.83621564 1.45983255 0.32381990E-04 0.15400000E+05 0.00025914 17.83161365 1.46400637 0.29905822E-04 0.15450000E+05 0.00024219 17.82578904 1.46209966 0.27833905E-04 0.15500000E+05 0.00022632 17.81920536 1.45716450 0.25995870E-04 0.15550000E+05 0.00021154 17.81257137 1.45438459 0.24174116E-04 0.15600000E+05 0.00019777 17.80639344 1.45679178 0.22278220E-04 0.15650000E+05 0.00018493 17.80063689 1.46256880 0.20390577E-04 0.15700000E+05 0.00017287 17.79472286 1.46537189 0.18669528E-04 0.15750000E+05 0.00016152 17.78787921 1.46171634 0.17219749E-04 0.15800000E+05 0.00015084 17.77963300 1.45703328 0.16024953E-04 0.15850000E+05 0.00014083 17.77013077 1.45802821 0.14973644E-04 0.15900000E+05 0.00013152 17.76006822 1.46248026 0.13946571E-04 0.15950000E+05 0.00012289 17.75024102 1.46432964 0.12890178E-04 0.16000000E+05 0.00011487 17.74097626 1.46301232 0.11825538E-04 ************************************************************************ info from reading or writing asymptotic info ************************************************************************ # timesteps for which bk coefs available is: 320 # data used, ndused = 320 effective prop.time, spectral resolution (mev) = 16000.0000 0.5342946E+01 meaningful results in kin energy range (ev) 0.005343 1.709743 results will be obtained for nen95 energies,nen95 = 150 ************************************************************************ info from gtaife ************************************************************************ ************************************************************************ info from probaf ************************************************************************ # of data skipped in between data in next printout = 0 idat ekin(ev) preact phase 1 0.4007209 0.002536 -1.19458 2 0.4060639 0.000992 -1.15028 3 0.4114068 -0.000736 -1.11211 4 0.4167498 -0.001148 -1.07867 5 0.4220927 -0.000369 -1.05783 6 0.4274357 0.001021 -1.05120 7 0.4327786 0.001866 -1.05269 8 0.4381216 0.001211 -1.05804 9 0.4434645 -0.000127 -1.06309 10 0.4488075 -0.000707 -1.06375 11 0.4541504 -0.000298 -1.06330 12 0.4594933 0.000681 -1.06806 13 0.4648363 0.001563 -1.07622 14 0.4701792 0.001273 -1.08092 15 0.4755222 -0.000124 -1.07961 16 0.4808651 -0.000801 -1.07299 17 0.4862081 0.000181 -1.06182 18 0.4915510 0.001409 -1.04899 19 0.4968940 0.001446 -1.03577 20 0.5022369 0.000600 -1.01565 21 0.5075799 -0.000020 -0.98168 22 0.5129228 0.000265 -0.93654 23 0.5182658 0.001260 -0.88576 24 0.5236087 0.001866 -0.82707 25 0.5289516 0.001401 -0.75478 26 0.5342946 0.000879 -0.66647 27 0.5396375 0.001600 -0.55948 28 0.5449805 0.003016 -0.43306 29 0.5503234 0.003780 -0.29561 30 0.5556664 0.004216 -0.15436 31 0.5610093 0.005922 -0.00592 32 0.5663523 0.009546 0.14737 33 0.5716952 0.014225 0.29103 34 0.5770382 0.018621 0.41726 35 0.5823811 0.021770 0.52998 36 0.5877240 0.023676 0.63436 37 0.5930670 0.025478 0.73532 38 0.5984099 0.028554 0.83765 39 0.6037529 0.033464 0.93918 40 0.6090958 0.040409 1.03145 41 0.6144388 0.050126 1.10969 42 0.6197817 0.063026 1.17279 43 0.6251247 0.077594 1.21408 44 0.6304676 0.090731 1.22837 45 0.6358106 0.100242 1.23247 46 0.6411535 0.106948 1.25628 47 0.6464965 0.113778 1.30609 48 0.6518394 0.122694 1.35882 49 0.6571823 0.133022 1.39383 50 0.6625253 0.142863 1.42128 51 0.6678682 0.151688 1.46908 52 0.6732112 0.160797 1.54100 53 0.6785541 0.171389 1.60984 54 0.6838971 0.182932 1.64462 55 0.6892400 0.193944 1.64040 56 0.6945830 0.203937 1.62626 57 0.6999259 0.213924 1.62352 58 0.7052689 0.225156 1.63154 59 0.7106118 0.237811 1.66937 60 0.7159548 0.251118 1.77252 61 0.7212977 0.264361 1.94368 62 0.7266406 0.277220 2.15664 63 0.7319836 0.289372 2.37933 64 0.7373265 0.300583 2.58932 65 0.7426695 0.311121 2.80230 66 0.7480124 0.321544 3.04137 67 0.7533554 0.332128 -3.01808 68 0.7586983 0.342900 -2.89073 69 0.7640413 0.353999 -2.84708 70 0.7693842 0.365541 -2.78324 71 0.7747272 0.377226 -2.68310 72 0.7800701 0.388581 -2.60600 73 0.7854130 0.399549 -2.56820 74 0.7907560 0.410433 -2.53191 75 0.7960989 0.421399 -2.49337 76 0.8014419 0.432323 -2.49237 77 0.8067848 0.442970 -2.52097 78 0.8121278 0.453057 -2.51480 79 0.8174707 0.462359 -2.46339 80 0.8228137 0.470904 -2.41167 81 0.8281566 0.479041 -2.38281 82 0.8334996 0.487234 -2.35136 83 0.8388425 0.495750 -2.30303 84 0.8441855 0.504413 -2.26475 85 0.8495284 0.512744 -2.25712 86 0.8548713 0.520526 -2.25864 87 0.8602143 0.528077 -2.25304 88 0.8655572 0.535757 -2.25791 89 0.8709002 0.543584 -2.27372 90 0.8762431 0.551595 -2.27272 91 0.8815861 0.560005 -2.26119 92 0.8869290 0.568688 -2.27030 93 0.8922720 0.577085 -2.28858 94 0.8976149 0.584911 -2.28412 95 0.9029579 0.592386 -2.28529 96 0.9083008 0.599750 -2.33626 97 0.9136437 0.607076 -2.39600 98 0.9189867 0.614461 -2.41298 99 0.9243296 0.621872 -2.43433 100 0.9296726 0.629127 -2.50641 101 0.9350155 0.636261 -2.57731 102 0.9403585 0.643471 -2.62677 103 0.9457014 0.650689 -2.70955 104 0.9510444 0.657755 -2.79776 105 0.9563873 0.664795 -2.82027 106 0.9617303 0.671913 -2.82003 107 0.9670732 0.678926 -2.84271 108 0.9724162 0.685786 -2.83974 109 0.9777591 0.692708 -2.78519 110 0.9831020 0.699704 -2.73272 111 0.9884450 0.706621 -2.70461 112 0.9937879 0.713594 -2.65226 113 0.9991309 0.720824 -2.56716 114 1.0044738 0.728195 -2.49829 115 1.0098168 0.735546 -2.45275 116 1.0151597 0.742928 -2.38360 117 1.0205027 0.750334 -2.29741 118 1.0258456 0.757606 -2.23685 119 1.0311886 0.764700 -2.18072 120 1.0365315 0.771660 -2.08813 121 1.0418744 0.778443 -2.00583 122 1.0472174 0.784987 -1.98257 123 1.0525603 0.791309 -1.94608 124 1.0579033 0.797446 -1.84696 125 1.0632462 0.803398 -1.76808 126 1.0685892 0.809123 -1.73875 127 1.0739321 0.814574 -1.65347 128 1.0792751 0.819762 -1.51020 129 1.0846180 0.824671 -1.41218 130 1.0899610 0.829217 -1.34267 131 1.0953039 0.833426 -1.18981 132 1.1006469 0.837442 -1.01215 133 1.1059898 0.841250 -0.92009 134 1.1113327 0.844775 -0.81462 135 1.1166757 0.848205 -0.57954 136 1.1220186 0.851745 -0.36201 137 1.1273616 0.855229 -0.30946 138 1.1327045 0.858402 -0.20508 139 1.1380475 0.861283 0.08737 140 1.1433904 0.864005 0.27251 141 1.1487334 0.866644 0.14292 142 1.1540763 0.869249 0.26278 143 1.1594193 0.871808 0.61579 144 1.1647622 0.874295 0.56248 145 1.1701052 0.876800 0.18045 146 1.1754481 0.879373 0.48762 147 1.1807910 0.881936 0.37057 148 1.1861340 0.884478 -0.68253 149 1.1914769 0.887047 -0.30002 150 1.1968199 0.889542 -0.21464 ******************************************************************************** PRINTING SCATTERING AND REACTION PROBABILITIES ******************************************************************************** etrans(icomin)= 0.400721 etrans(icomax)= 1.196820 etrans= 0.400000 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.39479287D+01 trans energy = 0.51428571D+00 trans energy in z = 0.51428571D+00 total momentum = 0.11784854D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9994810E+00 0.5794609E-01 0.2683926E-01 1 0.2769699E-09 0.0000000E+00 0.1481520E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.2556419E+00 0 37 1 0 0.4058697E-01 0 43 1 1 0.5412704E+00 0 21 3 -3 0.2685789E-01 0 26 3 -2 0.6262282E-02 0 32 3 -1 0.2220172E-02 0 38 3 0 0.2197097E-02 0 44 3 1 0.8537754E-02 0 49 3 2 0.1613799E-01 0 54 3 3 0.9874393E-01 0 13 5 -5 0.5802971E-04 0 17 5 -4 0.1415933E-04 0 22 5 -3 0.1171339E-04 0 27 5 -2 0.1676897E-04 0 33 5 -1 0.3075795E-04 0 39 5 0 0.2997786E-04 0 45 5 1 0.1996217E-03 0 50 5 2 0.1800642E-03 0 55 5 3 0.1426942E-03 0 59 5 4 0.6832984E-04 0 63 5 5 0.2724355E-03 0 7 7 -7 0.8781028E-11 0 10 7 -6 0.4516308E-11 0 14 7 -5 0.8747966E-11 0 18 7 -4 0.1749331E-11 0 23 7 -3 0.1795883E-11 0 28 7 -2 0.4738359E-11 0 34 7 -1 0.3251992E-10 0 40 7 0 0.2807005E-09 0 46 7 1 0.1614759E-08 0 51 7 2 0.7992993E-09 0 56 7 3 0.2683084E-09 0 60 7 4 0.4831914E-10 0 64 7 5 0.5020714E-11 0 67 7 6 0.1119716E-10 0 70 7 7 0.5197237E-10 0 3 9 -9 0.0000000E+00 0 5 9 -8 0.0000000E+00 0 8 9 -7 0.0000000E+00 0 11 9 -6 0.0000000E+00 0 15 9 -5 0.0000000E+00 0 19 9 -4 0.0000000E+00 0 24 9 -3 0.0000000E+00 0 29 9 -2 0.0000000E+00 0 35 9 -1 0.0000000E+00 0 41 9 0 0.0000000E+00 0 47 9 1 0.0000000E+00 0 52 9 2 0.0000000E+00 0 57 9 3 0.0000000E+00 0 61 9 4 0.0000000E+00 0 65 9 5 0.0000000E+00 0 68 9 6 0.0000000E+00 0 71 9 7 0.0000000E+00 0 73 9 8 0.0000000E+00 0 75 9 9 0.0000000E+00 0 1 11 -11 0.0000000E+00 0 2 11 -10 0.0000000E+00 0 4 11 -9 0.0000000E+00 0 6 11 -8 0.0000000E+00 0 9 11 -7 0.0000000E+00 0 12 11 -6 0.0000000E+00 0 16 11 -5 0.0000000E+00 0 20 11 -4 0.0000000E+00 0 25 11 -3 0.0000000E+00 0 30 11 -2 0.0000000E+00 0 36 11 -1 0.0000000E+00 0 42 11 0 0.0000000E+00 0 48 11 1 0.0000000E+00 0 53 11 2 0.0000000E+00 0 58 11 3 0.0000000E+00 0 62 11 4 0.0000000E+00 0 66 11 5 0.0000000E+00 0 69 11 6 0.0000000E+00 0 72 11 7 0.0000000E+00 0 74 11 8 0.0000000E+00 0 76 11 9 0.0000000E+00 0 77 11 10 0.0000000E+00 0 78 11 11 0.0000000E+00 1 31 1 -1 0.1716728E-14 1 37 1 0 0.4348891E-35 1 43 1 1 0.2769682E-09 1 21 3 -3 0.0000000E+00 1 26 3 -2 0.0000000E+00 1 32 3 -1 0.0000000E+00 1 38 3 0 0.0000000E+00 1 44 3 1 0.0000000E+00 1 49 3 2 0.0000000E+00 1 54 3 3 0.0000000E+00 1 13 5 -5 0.0000000E+00 1 17 5 -4 0.0000000E+00 1 22 5 -3 0.0000000E+00 1 27 5 -2 0.0000000E+00 1 33 5 -1 0.0000000E+00 1 39 5 0 0.0000000E+00 1 45 5 1 0.0000000E+00 1 50 5 2 0.0000000E+00 1 55 5 3 0.0000000E+00 1 59 5 4 0.0000000E+00 1 63 5 5 0.0000000E+00 1 7 7 -7 0.0000000E+00 1 10 7 -6 0.0000000E+00 1 14 7 -5 0.0000000E+00 1 18 7 -4 0.0000000E+00 1 23 7 -3 0.0000000E+00 1 28 7 -2 0.0000000E+00 1 34 7 -1 0.0000000E+00 1 40 7 0 0.0000000E+00 1 46 7 1 0.0000000E+00 1 51 7 2 0.0000000E+00 1 56 7 3 0.0000000E+00 1 60 7 4 0.0000000E+00 1 64 7 5 0.0000000E+00 1 67 7 6 0.0000000E+00 1 70 7 7 0.0000000E+00 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.0000000E+00 2 37 1 0 0.0000000E+00 2 43 1 1 0.0000000E+00 2 21 3 -3 0.0000000E+00 2 26 3 -2 0.0000000E+00 2 32 3 -1 0.0000000E+00 2 38 3 0 0.0000000E+00 2 44 3 1 0.0000000E+00 2 49 3 2 0.0000000E+00 2 54 3 3 0.0000000E+00 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.3298819E-12 1 0.3387147E-01 2 0.4048064E-01 3 0.9113825E-01 4 0.7776283E-01 5 0.1215608E-01 6 0.2324205E-03 7 0.2309625E-06 8 0.9889603E-11 9 0.9875675E-13 v, j, mj = 0 1 0 0 0.4536925E-32 1 0.7572155E-03 2 0.6116458E-02 3 0.2121142E-01 4 0.1147620E-01 5 0.1010847E-02 6 0.1477551E-04 7 0.5087733E-07 8 0.2263956E-11 9 0.9744697E-14 v, j, mj = 0 1 1 0 0.4709480E-01 1 0.8589199E-01 2 0.6356489E-01 3 0.2088615E+00 4 0.1214528E+00 5 0.1412154E-01 6 0.2824208E-03 7 0.4674478E-06 8 0.1205799E-10 9 0.1429413E-12 v, j, mj = 0 3 -3 0 0.1694827E-13 1 0.6246173E-02 2 0.7688189E-02 3 0.9149481E-02 4 0.3490121E-02 5 0.2820701E-03 6 0.1850367E-05 7 0.1496223E-09 8 0.2163144E-11 9 0.0000000E+00 v, j, mj = 0 3 -2 0 0.2287518E-32 1 0.2531020E-03 2 0.8405951E-03 3 0.3093026E-02 4 0.1868614E-02 5 0.2038428E-03 6 0.3100664E-05 7 0.1455527E-08 8 0.3562065E-12 9 0.0000000E+00 v, j, mj = 0 3 -1 0 0.1124860E-13 1 0.1843258E-03 2 0.4362810E-03 3 0.8787309E-03 4 0.6188044E-03 5 0.1001923E-03 6 0.1836804E-05 7 0.1063201E-08 8 0.2174207E-12 9 0.0000000E+00 v, j, mj = 0 3 0 0 0.5920356E-33 1 0.6549289E-05 2 0.3628238E-03 3 0.9625838E-03 4 0.7449580E-03 5 0.1182099E-03 6 0.1971488E-05 7 0.8419776E-09 8 0.2103452E-12 9 0.0000000E+00 v, j, mj = 0 3 1 0 0.1024767E-03 1 0.2444662E-03 2 0.1757111E-02 3 0.4253819E-02 4 0.2022788E-02 5 0.1554860E-03 6 0.1606085E-05 7 0.7692079E-09 8 0.2670087E-12 9 0.0000000E+00 v, j, mj = 0 3 2 0 0.5730367E-33 1 0.1736719E-03 2 0.3411666E-02 3 0.7421952E-02 4 0.4604705E-02 5 0.5208629E-03 6 0.5130984E-05 7 0.1016886E-08 8 0.8939547E-12 9 0.0000000E+00 v, j, mj = 0 3 3 0 0.3400764E-14 1 0.1797052E-01 2 0.2762462E-01 3 0.4179444E-01 4 0.1095572E-01 5 0.3979124E-03 6 0.7098870E-06 7 0.1498465E-09 8 0.3690106E-11 9 0.0000000E+00 v, j, mj = 0 5 -5 0 0.1049625E-04 1 0.1740322E-04 2 0.2405634E-04 3 0.5776523E-05 4 0.2958823E-06 5 0.1485398E-08 6 0.1401669E-10 7 0.5719743E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 -4 0 0.3011244E-33 1 0.2658812E-05 2 0.6998629E-05 3 0.3945552E-05 4 0.5455178E-06 5 0.1081827E-07 6 0.2422573E-11 7 0.5663784E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 -3 0 0.3801232E-15 1 0.8434867E-06 2 0.2675166E-05 3 0.6157812E-05 4 0.1998638E-05 5 0.3828074E-07 6 0.9009448E-11 7 0.9883965E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 -2 0 0.8889594E-34 1 0.3763839E-07 2 0.3377410E-05 3 0.1047849E-04 4 0.2824932E-05 5 0.5048278E-07 6 0.1421526E-10 7 0.1842322E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 -1 0 0.5733439E-16 1 0.3771899E-06 2 0.8936621E-05 3 0.1778604E-04 4 0.3604616E-05 5 0.5346932E-07 6 0.1145315E-10 7 0.1725887E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 0 0 0.1603213E-33 1 0.8975886E-05 2 0.1392629E-04 3 0.6471531E-05 4 0.5993813E-06 5 0.4769863E-08 6 0.1133608E-11 7 0.3608788E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 1 0 0.2017160E-04 1 0.1248395E-04 2 0.8835999E-04 3 0.7029863E-04 4 0.8229525E-05 5 0.7803769E-07 6 0.1088622E-10 7 0.3906487E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 2 0 0.7676735E-33 1 0.7286786E-05 2 0.6894182E-04 3 0.8950980E-04 4 0.1416378E-04 5 0.1619970E-06 6 0.3744934E-10 7 0.1358061E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 3 0 0.2904972E-15 1 0.7075966E-05 2 0.5166237E-04 3 0.7261886E-04 4 0.1120726E-04 5 0.1296821E-06 6 0.4465751E-10 7 0.2995292E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 4 0 0.2006191E-33 1 0.1918088E-05 2 0.2564527E-04 3 0.3344919E-04 4 0.7222826E-05 5 0.9444340E-07 6 0.2324572E-10 7 0.8095198E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 5 5 0 0.6659287E-15 1 0.1315957E-03 2 0.1012445E-03 3 0.3762162E-04 4 0.1964127E-05 5 0.9547607E-08 6 0.2634056E-10 7 0.8944073E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -7 0 0.2820396E-15 1 0.1794352E-11 2 0.4892664E-11 3 0.1517865E-11 4 0.5758639E-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 7 -6 0 0.3599289E-34 1 0.2515082E-11 2 0.1503200E-11 3 0.4498107E-12 4 0.4821514E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -5 0 0.6845160E-11 1 0.6872355E-12 2 0.7896876E-12 3 0.1915792E-12 4 0.2343036E-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 7 -4 0 0.9032792E-34 1 0.1226171E-11 2 0.2058104E-12 3 0.1509093E-12 4 0.1664399E-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 7 -3 0 0.2759204E-16 1 0.2736100E-12 2 0.1218826E-11 3 0.1893857E-12 4 0.1140335E-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 7 -2 0 0.1316191E-33 1 0.1872577E-11 2 0.2607698E-11 3 0.1649461E-12 4 0.9313742E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -1 0 0.1633898E-16 1 0.2678623E-10 2 0.5288912E-11 3 0.3249587E-12 4 0.1198063E-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 7 0 0 0.1261019E-34 1 0.2677617E-09 2 0.1158788E-10 3 0.1033243E-11 4 0.3176460E-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 7 1 0 0.1254091E-08 1 0.3213188E-09 2 0.3302780E-10 3 0.4186300E-11 4 0.2135515E-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 7 2 0 0.1485193E-33 1 0.7456049E-09 2 0.4780324E-10 3 0.4340934E-11 4 0.1550234E-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 7 3 0 0.5838006E-16 1 0.2168997E-09 2 0.4924390E-10 3 0.1988048E-11 4 0.1767128E-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 7 4 0 0.1827874E-33 1 0.1636773E-10 2 0.2899823E-10 3 0.2250581E-11 4 0.7026006E-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 7 5 0 0.4511950E-16 1 0.6649047E-13 2 0.3180494E-11 3 0.7741696E-12 4 0.9995154E-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 7 6 0 0.2982301E-34 1 0.5982946E-11 2 0.4002812E-11 3 0.8888199E-12 4 0.3225849E-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 7 7 0 0.4150758E-10 1 0.2135238E-11 2 0.3603875E-11 3 0.2931786E-11 4 0.1793890E-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 1 -1 0 0.1716728E-14 1 0.0000000E+00 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 1 0 0 0.4348891E-35 1 0.0000000E+00 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 1 1 0 0.2769682E-09 1 0.0000000E+00 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 = 0.9994810 average vibrational energy (ev) = 0.000000 average rotational energy (ev) = 0.026839 average diffraction energy (ev) = 0.057946 the reaction probability = 0.5190101D-03 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.38336430D+01 trans energy = 0.62857143D+00 trans energy in z = 0.62857143D+00 total momentum = 0.13028646D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.9139314E+00 0.8536073E-01 0.3830864E-01 1 0.1949084E-07 0.1027619E-01 0.1678286E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.2454246E+00 0 37 1 0 0.3268621E-01 0 43 1 1 0.3620458E+00 0 21 3 -3 0.7959932E-01 0 26 3 -2 0.1103741E-01 0 32 3 -1 0.9185306E-02 0 38 3 0 0.1202374E-02 0 44 3 1 0.1700406E-01 0 49 3 2 0.2279502E-01 0 54 3 3 0.1222513E+00 0 13 5 -5 0.1681809E-02 0 17 5 -4 0.2385700E-03 0 22 5 -3 0.1932263E-03 0 27 5 -2 0.1553402E-03 0 33 5 -1 0.2627225E-03 0 39 5 0 0.1582789E-03 0 45 5 1 0.6967221E-03 0 50 5 2 0.8328920E-03 0 55 5 3 0.9761947E-03 0 59 5 4 0.8547480E-03 0 63 5 5 0.4647369E-02 0 7 7 -7 0.2916364E-07 0 10 7 -6 0.1136416E-07 0 14 7 -5 0.1194638E-07 0 18 7 -4 0.5338699E-08 0 23 7 -3 0.1129504E-07 0 28 7 -2 0.2446574E-07 0 34 7 -1 0.6942372E-07 0 40 7 0 0.1878763E-06 0 46 7 1 0.4517889E-06 0 51 7 2 0.4235992E-06 0 56 7 3 0.3002682E-06 0 60 7 4 0.1295787E-06 0 64 7 5 0.4978626E-07 0 67 7 6 0.5824897E-07 0 70 7 7 0.2197320E-06 0 3 9 -9 0.2333636E-14 0 5 9 -8 0.1006620E-13 0 8 9 -7 0.9431155E-14 0 11 9 -6 0.1326731E-14 0 15 9 -5 0.1673340E-13 0 19 9 -4 0.2439350E-14 0 24 9 -3 0.4356793E-14 0 29 9 -2 0.1843754E-13 0 35 9 -1 0.5100333E-14 0 41 9 0 0.2081872E-15 0 47 9 1 0.1380047E-13 0 52 9 2 0.8852095E-15 0 57 9 3 0.1789545E-13 0 61 9 4 0.1741680E-13 0 65 9 5 0.1231172E-13 0 68 9 6 0.3788448E-13 0 71 9 7 0.8213324E-13 0 73 9 8 0.3499414E-14 0 75 9 9 0.6863156E-13 0 1 11 -11 0.0000000E+00 0 2 11 -10 0.0000000E+00 0 4 11 -9 0.0000000E+00 0 6 11 -8 0.0000000E+00 0 9 11 -7 0.0000000E+00 0 12 11 -6 0.0000000E+00 0 16 11 -5 0.0000000E+00 0 20 11 -4 0.0000000E+00 0 25 11 -3 0.0000000E+00 0 30 11 -2 0.0000000E+00 0 36 11 -1 0.0000000E+00 0 42 11 0 0.0000000E+00 0 48 11 1 0.0000000E+00 0 53 11 2 0.0000000E+00 0 58 11 3 0.0000000E+00 0 62 11 4 0.0000000E+00 0 66 11 5 0.0000000E+00 0 69 11 6 0.0000000E+00 0 72 11 7 0.0000000E+00 0 74 11 8 0.0000000E+00 0 76 11 9 0.0000000E+00 0 77 11 10 0.0000000E+00 0 78 11 11 0.0000000E+00 1 31 1 -1 0.3679413E-08 1 37 1 0 0.6629273E-10 1 43 1 1 0.1522245E-07 1 21 3 -3 0.1172063E-09 1 26 3 -2 0.3066778E-10 1 32 3 -1 0.1151935E-10 1 38 3 0 0.1722956E-10 1 44 3 1 0.2295349E-10 1 49 3 2 0.5265068E-10 1 54 3 3 0.2704489E-09 1 13 5 -5 0.0000000E+00 1 17 5 -4 0.0000000E+00 1 22 5 -3 0.0000000E+00 1 27 5 -2 0.0000000E+00 1 33 5 -1 0.0000000E+00 1 39 5 0 0.0000000E+00 1 45 5 1 0.0000000E+00 1 50 5 2 0.0000000E+00 1 55 5 3 0.0000000E+00 1 59 5 4 0.0000000E+00 1 63 5 5 0.0000000E+00 1 7 7 -7 0.0000000E+00 1 10 7 -6 0.0000000E+00 1 14 7 -5 0.0000000E+00 1 18 7 -4 0.0000000E+00 1 23 7 -3 0.0000000E+00 1 28 7 -2 0.0000000E+00 1 34 7 -1 0.0000000E+00 1 40 7 0 0.0000000E+00 1 46 7 1 0.0000000E+00 1 51 7 2 0.0000000E+00 1 56 7 3 0.0000000E+00 1 60 7 4 0.0000000E+00 1 64 7 5 0.0000000E+00 1 67 7 6 0.0000000E+00 1 70 7 7 0.0000000E+00 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.0000000E+00 2 37 1 0 0.0000000E+00 2 43 1 1 0.0000000E+00 2 21 3 -3 0.0000000E+00 2 26 3 -2 0.0000000E+00 2 32 3 -1 0.0000000E+00 2 38 3 0 0.0000000E+00 2 44 3 1 0.0000000E+00 2 49 3 2 0.0000000E+00 2 54 3 3 0.0000000E+00 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.6691169E-11 1 0.2138818E-01 2 0.3116205E-01 3 0.3886621E-01 4 0.7844381E-01 5 0.6707990E-01 6 0.8351546E-02 7 0.1327767E-03 8 0.1666691E-06 9 0.7524502E-11 v, j, mj = 0 1 0 0 0.4721497E-33 1 0.1429092E-03 2 0.2396851E-02 3 0.4774329E-02 4 0.1788406E-01 5 0.7049612E-02 6 0.4346500E-03 7 0.3793317E-05 8 0.6204793E-08 9 0.3739750E-12 v, j, mj = 0 1 1 0 0.1956463E-01 1 0.4088040E-02 2 0.1090251E+00 3 0.4455278E-01 4 0.9933437E-01 5 0.7633311E-01 6 0.9009914E-02 7 0.1376898E-03 8 0.1375713E-06 9 0.5230594E-11 v, j, mj = 0 3 -3 0 0.1584883E-11 1 0.2051563E-01 2 0.1987583E-01 3 0.2049226E-01 4 0.1401462E-01 5 0.4478316E-02 6 0.2219679E-03 7 0.6874380E-06 8 0.7521539E-10 9 0.6365681E-12 v, j, mj = 0 3 -2 0 0.3134612E-33 1 0.5542773E-03 2 0.9060781E-03 3 0.2326073E-02 4 0.5455788E-02 5 0.1688988E-02 6 0.1049167E-03 7 0.1290650E-05 8 0.5759868E-09 9 0.4709287E-13 v, j, mj = 0 3 -1 0 0.4071393E-13 1 0.5678157E-03 2 0.1162516E-02 3 0.2739550E-02 4 0.2861021E-02 5 0.1683278E-02 6 0.1693537E-03 7 0.1770654E-05 8 0.6498005E-09 9 0.8426783E-13 v, j, mj = 0 3 0 0 0.1008434E-32 1 0.8307828E-04 2 0.8458271E-04 3 0.3622189E-03 4 0.4307342E-03 5 0.2133783E-03 6 0.2791839E-04 7 0.4628410E-06 8 0.2258062E-09 9 0.1947414E-13 v, j, mj = 0 3 1 0 0.5710207E-03 1 0.2239139E-03 2 0.1853584E-02 3 0.2512878E-02 4 0.8854310E-02 5 0.2850941E-02 6 0.1362311E-03 7 0.1184836E-05 8 0.6789537E-09 9 0.8764317E-13 v, j, mj = 0 3 2 0 0.4297150E-33 1 0.1306073E-03 2 0.7142266E-03 3 0.8114106E-02 4 0.9506026E-02 5 0.4066202E-02 6 0.2625527E-03 7 0.1295566E-05 8 0.8342501E-10 9 0.1009852E-12 v, j, mj = 0 3 3 0 0.3138295E-11 1 0.1857292E-01 2 0.2168634E-01 3 0.3093549E-01 4 0.4065798E-01 5 0.1004990E-01 6 0.3470721E-03 7 0.1636084E-05 8 0.5128685E-09 9 0.1148627E-11 v, j, mj = 0 5 -5 0 0.3436413E-03 1 0.3299913E-03 2 0.6436428E-03 3 0.2962095E-03 4 0.6612861E-04 5 0.2186697E-05 6 0.9103991E-08 7 0.6521061E-11 8 0.3115139E-12 9 0.0000000E+00 v, j, mj = 0 5 -4 0 0.7551634E-34 1 0.1261955E-04 2 0.9079783E-04 3 0.9895933E-04 4 0.3234763E-04 5 0.3768529E-05 6 0.7710370E-07 7 0.2748775E-10 8 0.1158484E-12 9 0.0000000E+00 v, j, mj = 0 5 -3 0 0.1203127E-14 1 0.1117369E-04 2 0.2886971E-04 3 0.6437791E-04 4 0.7238591E-04 5 0.1611058E-04 6 0.3084268E-06 7 0.8850625E-10 8 0.1585982E-12 9 0.0000000E+00 v, j, mj = 0 5 -2 0 0.3851005E-33 1 0.1057688E-05 2 0.3394967E-05 3 0.4174958E-04 4 0.8771350E-04 5 0.2105387E-04 6 0.3704793E-06 7 0.1077971E-09 8 0.7114246E-14 9 0.0000000E+00 v, j, mj = 0 5 -1 0 0.3783729E-15 1 0.8202100E-05 2 0.4821327E-05 3 0.7460420E-04 4 0.1469161E-03 5 0.2777353E-04 6 0.4051316E-06 7 0.9836309E-10 8 0.1423932E-12 9 0.0000000E+00 v, j, mj = 0 5 0 0 0.3539322E-33 1 0.1188840E-05 2 0.2922588E-04 3 0.8266232E-04 4 0.4162990E-04 5 0.3535756E-05 6 0.3618964E-07 7 0.1117926E-10 8 0.4735638E-13 9 0.0000000E+00 v, j, mj = 0 5 1 0 0.7084330E-05 1 0.1264460E-03 2 0.1154020E-03 3 0.1933112E-03 4 0.2286165E-03 5 0.2560605E-04 6 0.2559894E-06 7 0.3755978E-10 8 0.1791712E-12 9 0.0000000E+00 v, j, mj = 0 5 2 0 0.5037058E-33 1 0.6497252E-05 2 0.3786863E-04 3 0.3097699E-03 4 0.4186486E-03 5 0.5941497E-04 6 0.6925670E-06 7 0.1343090E-09 8 0.1849171E-12 9 0.0000000E+00 v, j, mj = 0 5 3 0 0.1113187E-14 1 0.3878512E-04 2 0.6114053E-04 3 0.4076814E-03 4 0.4111410E-03 5 0.5679173E-04 6 0.6548284E-06 7 0.1138661E-09 8 0.1557321E-12 9 0.0000000E+00 v, j, mj = 0 5 4 0 0.3315378E-33 1 0.1008723E-03 2 0.1591853E-03 3 0.3090664E-03 4 0.2480541E-03 5 0.3709762E-04 6 0.4723162E-06 7 0.7615437E-10 8 0.4760071E-12 9 0.0000000E+00 v, j, mj = 0 5 5 0 0.8670806E-14 1 0.1715486E-02 2 0.1517277E-02 3 0.1177843E-02 4 0.2297588E-03 5 0.6993256E-05 6 0.1222930E-07 7 0.3783435E-10 8 0.5321780E-12 9 0.0000000E+00 v, j, mj = 0 7 -7 0 0.7010266E-15 1 0.1191783E-07 2 0.1480980E-07 3 0.2388315E-08 4 0.4410801E-10 5 0.2921293E-11 6 0.6605080E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -6 0 0.3272744E-34 1 0.3668160E-08 2 0.5685944E-08 3 0.1964683E-08 4 0.4491428E-10 5 0.2570131E-12 6 0.1979724E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -5 0 0.1422381E-08 1 0.2617092E-08 2 0.6283127E-08 3 0.1586044E-08 4 0.3688625E-10 5 0.5811964E-12 6 0.2690037E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -4 0 0.2110860E-34 1 0.6475317E-09 2 0.2336658E-08 3 0.2174042E-08 4 0.1797000E-09 5 0.6163854E-12 6 0.1512305E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -3 0 0.4007740E-16 1 0.9399522E-10 2 0.4216704E-08 3 0.6416496E-08 4 0.5658846E-09 5 0.1785129E-11 6 0.1712515E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -2 0 0.1167016E-34 1 0.1612365E-08 2 0.1151227E-07 3 0.1058348E-07 4 0.7561973E-09 5 0.1324533E-11 6 0.1122462E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -1 0 0.2255660E-16 1 0.1461851E-07 2 0.3896824E-07 3 0.1523262E-07 4 0.6027389E-09 5 0.1135258E-11 6 0.4761879E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 0 0 0.8802400E-34 1 0.9013176E-07 2 0.7226716E-07 3 0.2466421E-07 4 0.8122270E-09 5 0.8748003E-12 6 0.9671434E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 1 0 0.2638959E-06 1 0.1245770E-06 2 0.4271594E-07 3 0.1947970E-07 4 0.1119397E-08 5 0.7506636E-12 6 0.1309134E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 2 0 0.3063115E-34 1 0.1549773E-06 2 0.1664744E-06 3 0.9701364E-07 4 0.5129256E-08 5 0.4101956E-11 6 0.5145407E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 3 0 0.8839820E-16 1 0.2775322E-07 2 0.1577143E-06 3 0.1090323E-06 4 0.5762392E-08 5 0.5309240E-11 6 0.5735642E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 4 0 0.2567075E-34 1 0.3803055E-08 2 0.6443786E-07 3 0.5778547E-07 4 0.3544222E-08 5 0.7195755E-11 6 0.9421751E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 5 0 0.6919023E-16 1 0.6226134E-08 2 0.2390528E-07 3 0.1849451E-07 4 0.1157672E-08 5 0.2223821E-11 6 0.4403922E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 6 0 0.5771666E-34 1 0.1474516E-07 2 0.3589798E-07 3 0.7435980E-08 4 0.1660858E-09 5 0.2610390E-11 6 0.1147697E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 7 0 0.5630818E-07 1 0.8841588E-07 2 0.6698897E-07 3 0.7942259E-08 4 0.7128770E-10 5 0.4427411E-11 6 0.1037011E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -9 0 0.1239802E-16 1 0.2321238E-14 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 = 0 9 -8 0 0.2370546E-34 1 0.1006620E-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 = 0 9 -7 0 0.2370284E-18 1 0.9430918E-14 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 = 0 9 -6 0 0.3829768E-35 1 0.1326731E-14 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 = 0 9 -5 0 0.7479853E-14 1 0.9253550E-14 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 = 0 9 -4 0 0.2021564E-34 1 0.2439350E-14 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 = 0 9 -3 0 0.9363725E-17 1 0.4347430E-14 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 = 0 9 -2 0 0.8685288E-34 1 0.1843754E-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 = 0 9 -1 0 0.1531951E-17 1 0.5098801E-14 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 = 0 9 0 0 0.2025722E-34 1 0.2081872E-15 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 = 0 9 1 0 0.5832414E-14 1 0.7968053E-14 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 = 0 9 2 0 0.4175340E-36 1 0.8852095E-15 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 = 0 9 3 0 0.8692171E-18 1 0.1789458E-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 = 0 9 4 0 0.8227119E-35 1 0.1741680E-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 = 0 9 5 0 0.1286609E-17 1 0.1231043E-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 = 0 9 6 0 0.5482510E-34 1 0.3788448E-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 = 0 9 7 0 0.2568324E-13 1 0.5644999E-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 = 0 9 8 0 0.2454711E-34 1 0.3499414E-14 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 = 0 9 9 0 0.1843148E-16 1 0.6861313E-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 1 -1 0 0.4314153E-13 1 0.2173312E-08 2 0.9279274E-09 3 0.4185773E-09 4 0.1595537E-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 1 0 0 0.4681553E-33 1 0.8204687E-11 2 0.2631623E-10 3 0.1612151E-10 4 0.1565030E-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 1 1 0 0.1067505E-07 1 0.2223631E-08 2 0.1950348E-08 3 0.2080822E-09 4 0.1653449E-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 3 -3 0 0.9758449E-15 1 0.6561662E-11 2 0.1106436E-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 3 -2 0 0.2819257E-33 1 0.2199661E-10 2 0.8671172E-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 3 -1 0 0.1841807E-15 1 0.7467790E-11 2 0.4051379E-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 3 0 0 0.1561734E-34 1 0.3790527E-11 2 0.1343903E-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 3 1 0 0.3199895E-11 1 0.9909528E-11 2 0.9844068E-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 3 2 0 0.1335610E-32 1 0.1949263E-10 2 0.3315805E-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 3 3 0 0.4814830E-16 1 0.7353182E-10 2 0.1969170E-09 3 0.0000000E+00 4 0.0000000E+00 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.9139314 average vibrational energy (ev) = 0.000000 average rotational energy (ev) = 0.038309 average diffraction energy (ev) = 0.085361 the reaction probability = 0.8606862D-01 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.37193573D+01 trans energy = 0.74285714D+00 trans energy in z = 0.74285714D+00 total momentum = 0.14163631D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.6885045E+00 0.1221115E+00 0.5133838E-01 1 0.8212577E-05 0.1124099E-01 0.1485621E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.1738076E+00 0 37 1 0 0.2854031E-01 0 43 1 1 0.2235390E+00 0 21 3 -3 0.5985155E-01 0 26 3 -2 0.1307485E-01 0 32 3 -1 0.1320337E-01 0 38 3 0 0.2365043E-02 0 44 3 1 0.1879088E-01 0 49 3 2 0.2825383E-01 0 54 3 3 0.8184249E-01 0 13 5 -5 0.1105702E-01 0 17 5 -4 0.1001816E-02 0 22 5 -3 0.1135784E-02 0 27 5 -2 0.6421726E-03 0 33 5 -1 0.8397436E-03 0 39 5 0 0.3911382E-03 0 45 5 1 0.1083153E-02 0 50 5 2 0.1890102E-02 0 55 5 3 0.3105190E-02 0 59 5 4 0.3900344E-02 0 63 5 5 0.2001897E-01 0 7 7 -7 0.2809380E-04 0 10 7 -6 0.1241928E-05 0 14 7 -5 0.1199698E-05 0 18 7 -4 0.4855924E-06 0 23 7 -3 0.8595725E-06 0 28 7 -2 0.1548241E-05 0 34 7 -1 0.2446925E-05 0 40 7 0 0.4200983E-05 0 46 7 1 0.8852312E-05 0 51 7 2 0.9207424E-05 0 56 7 3 0.9339141E-05 0 60 7 4 0.5483033E-05 0 64 7 5 0.4360885E-05 0 67 7 6 0.7532221E-05 0 70 7 7 0.8525321E-04 0 3 9 -9 0.6086502E-12 0 5 9 -8 0.3465048E-12 0 8 9 -7 0.3050249E-12 0 11 9 -6 0.1240754E-12 0 15 9 -5 0.2007838E-12 0 19 9 -4 0.2540316E-12 0 24 9 -3 0.8081930E-13 0 29 9 -2 0.2755016E-12 0 35 9 -1 0.4587635E-12 0 41 9 0 0.3604474E-11 0 47 9 1 0.9854887E-11 0 52 9 2 0.6787482E-11 0 57 9 3 0.1807720E-11 0 61 9 4 0.6984872E-12 0 65 9 5 0.5372328E-12 0 68 9 6 0.5935145E-12 0 71 9 7 0.6971978E-12 0 73 9 8 0.4230565E-12 0 75 9 9 0.5162311E-11 0 1 11 -11 0.0000000E+00 0 2 11 -10 0.0000000E+00 0 4 11 -9 0.0000000E+00 0 6 11 -8 0.0000000E+00 0 9 11 -7 0.0000000E+00 0 12 11 -6 0.0000000E+00 0 16 11 -5 0.0000000E+00 0 20 11 -4 0.0000000E+00 0 25 11 -3 0.0000000E+00 0 30 11 -2 0.0000000E+00 0 36 11 -1 0.0000000E+00 0 42 11 0 0.0000000E+00 0 48 11 1 0.0000000E+00 0 53 11 2 0.0000000E+00 0 58 11 3 0.0000000E+00 0 62 11 4 0.0000000E+00 0 66 11 5 0.0000000E+00 0 69 11 6 0.0000000E+00 0 72 11 7 0.0000000E+00 0 74 11 8 0.0000000E+00 0 76 11 9 0.0000000E+00 0 77 11 10 0.0000000E+00 0 78 11 11 0.0000000E+00 1 31 1 -1 0.1381871E-05 1 37 1 0 0.2708671E-07 1 43 1 1 0.6799438E-05 1 21 3 -3 0.1631600E-08 1 26 3 -2 0.2965323E-09 1 32 3 -1 0.2970885E-09 1 38 3 0 0.7491023E-10 1 44 3 1 0.4000185E-09 1 49 3 2 0.7993534E-10 1 54 3 3 0.1169144E-08 1 13 5 -5 0.1614257E-09 1 17 5 -4 0.1387998E-11 1 22 5 -3 0.1901706E-11 1 27 5 -2 0.1058453E-11 1 33 5 -1 0.6534018E-12 1 39 5 0 0.3731377E-12 1 45 5 1 0.9621108E-12 1 50 5 2 0.3041995E-12 1 55 5 3 0.2527249E-11 1 59 5 4 0.1037541E-10 1 63 5 5 0.5113801E-10 1 7 7 -7 0.0000000E+00 1 10 7 -6 0.0000000E+00 1 14 7 -5 0.0000000E+00 1 18 7 -4 0.0000000E+00 1 23 7 -3 0.0000000E+00 1 28 7 -2 0.0000000E+00 1 34 7 -1 0.0000000E+00 1 40 7 0 0.0000000E+00 1 46 7 1 0.0000000E+00 1 51 7 2 0.0000000E+00 1 56 7 3 0.0000000E+00 1 60 7 4 0.0000000E+00 1 64 7 5 0.0000000E+00 1 67 7 6 0.0000000E+00 1 70 7 7 0.0000000E+00 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.0000000E+00 2 37 1 0 0.0000000E+00 2 43 1 1 0.0000000E+00 2 21 3 -3 0.0000000E+00 2 26 3 -2 0.0000000E+00 2 32 3 -1 0.0000000E+00 2 38 3 0 0.0000000E+00 2 44 3 1 0.0000000E+00 2 49 3 2 0.0000000E+00 2 54 3 3 0.0000000E+00 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.4384136E-09 1 0.2476125E-02 2 0.8599230E-02 3 0.3485853E-01 4 0.2187861E-01 5 0.5886430E-01 6 0.4312078E-01 7 0.3966879E-02 8 0.4312867E-04 9 0.3004208E-07 v, j, mj = 0 1 0 0 0.3545607E-32 1 0.7218638E-03 2 0.1072477E-02 3 0.4769170E-02 4 0.5583815E-02 5 0.1239178E-01 6 0.3777083E-02 7 0.2220436E-03 8 0.2076916E-05 9 0.1302672E-08 v, j, mj = 0 1 1 0 0.8586886E-03 1 0.1465399E-01 2 0.3267251E-01 3 0.4433087E-01 4 0.3733086E-01 5 0.5141559E-01 6 0.3887961E-01 7 0.3366084E-02 8 0.3079744E-04 9 0.1523107E-07 v, j, mj = 0 3 -3 0 0.9560589E-10 1 0.1981305E-02 2 0.7789323E-02 3 0.1848148E-01 4 0.1473493E-01 5 0.1325079E-01 6 0.3481121E-02 7 0.1320675E-03 8 0.5312878E-06 9 0.9726458E-10 v, j, mj = 0 3 -2 0 0.8134363E-33 1 0.6757514E-03 2 0.9253679E-03 3 0.1643377E-02 4 0.4531500E-02 5 0.4617687E-02 6 0.6647064E-03 7 0.1631405E-04 8 0.1464878E-06 9 0.7378010E-10 v, j, mj = 0 3 -1 0 0.3971254E-11 1 0.9589416E-04 2 0.5137138E-03 3 0.2015156E-02 4 0.3565437E-02 5 0.4800455E-02 6 0.2082417E-02 7 0.1294351E-03 8 0.8612936E-06 9 0.1551717E-09 v, j, mj = 0 3 0 0 0.1809028E-32 1 0.7497206E-04 2 0.3095107E-03 3 0.5116047E-03 4 0.4350211E-03 5 0.7557197E-03 6 0.2609322E-03 7 0.1714272E-04 8 0.1398287E-06 9 0.3949240E-10 v, j, mj = 0 3 1 0 0.1621613E-03 1 0.1298965E-02 2 0.7320277E-03 3 0.2156803E-02 4 0.4524106E-02 5 0.8301223E-02 6 0.1580512E-02 7 0.3495303E-04 8 0.1256879E-06 9 0.8716355E-10 v, j, mj = 0 3 2 0 0.9765005E-33 1 0.4524770E-03 2 0.1628996E-02 3 0.5204441E-02 4 0.1082434E-01 5 0.8277210E-02 6 0.1806960E-02 7 0.5927019E-04 8 0.1328923E-06 9 0.2363985E-10 v, j, mj = 0 3 3 0 0.3243309E-10 1 0.5369285E-02 2 0.5233675E-02 3 0.1724797E-01 4 0.1734455E-01 5 0.2956713E-01 6 0.6832201E-02 7 0.2465982E-03 8 0.1077331E-05 9 0.9406013E-10 v, j, mj = 0 5 -5 0 0.2301504E-02 1 0.2128353E-02 2 0.3966546E-02 3 0.1445658E-02 4 0.1070299E-02 5 0.1400627E-03 6 0.4574277E-05 7 0.1939814E-07 8 0.4416234E-11 9 0.9391037E-12 v, j, mj = 0 5 -4 0 0.1175770E-33 1 0.1698837E-04 2 0.2921425E-03 3 0.3443601E-03 4 0.2773763E-03 5 0.6497256E-04 6 0.5858622E-05 7 0.1174081E-06 8 0.3916326E-10 9 0.1567926E-13 v, j, mj = 0 5 -3 0 0.8423360E-12 1 0.7391727E-04 2 0.1540187E-03 3 0.2945425E-03 4 0.3611895E-03 5 0.2168798E-03 6 0.3474579E-04 7 0.4898341E-06 8 0.1144864E-09 9 0.3805042E-12 v, j, mj = 0 5 -2 0 0.3335747E-33 1 0.3656888E-05 2 0.1247037E-04 3 0.9275534E-04 4 0.1944439E-03 5 0.2898173E-03 6 0.4842360E-04 7 0.6049884E-06 8 0.1464612E-09 9 0.4534745E-13 v, j, mj = 0 5 -1 0 0.1697726E-12 1 0.2311714E-04 2 0.3589389E-04 3 0.7641625E-04 4 0.2490482E-03 5 0.4011948E-03 6 0.5347928E-04 7 0.5938395E-06 8 0.1659669E-09 9 0.1412315E-12 v, j, mj = 0 5 0 0 0.1894077E-33 1 0.2699337E-05 2 0.3002502E-04 3 0.6586940E-04 4 0.1948123E-03 5 0.9121488E-04 6 0.6450116E-05 7 0.6710020E-07 8 0.2062004E-10 9 0.8636899E-13 v, j, mj = 0 5 1 0 0.3653320E-04 1 0.1469891E-04 2 0.3622348E-03 3 0.1069334E-03 4 0.3126007E-03 5 0.2309798E-03 6 0.1901976E-04 7 0.1523008E-06 8 0.4372134E-10 9 0.2137557E-12 v, j, mj = 0 5 2 0 0.4006562E-33 1 0.3778404E-05 2 0.1211887E-03 3 0.1662445E-03 4 0.8057313E-03 5 0.7193839E-03 6 0.7315358E-04 7 0.6210500E-06 8 0.1222705E-09 9 0.9006240E-13 v, j, mj = 0 5 3 0 0.3942850E-12 1 0.1388141E-03 2 0.1883019E-03 3 0.6353898E-03 4 0.1226561E-02 5 0.8386746E-03 6 0.7677927E-04 7 0.6691352E-06 8 0.1566425E-09 9 0.5262282E-12 v, j, mj = 0 5 4 0 0.9595521E-33 1 0.4493415E-03 2 0.5545415E-03 3 0.1118892E-02 4 0.1270575E-02 5 0.4615523E-03 6 0.4510634E-04 7 0.3364183E-06 8 0.3867303E-10 9 0.1368195E-12 v, j, mj = 0 5 5 0 0.1198734E-10 1 0.6794037E-02 2 0.5283341E-02 3 0.5572373E-02 4 0.1930527E-02 5 0.4258774E-03 6 0.1269102E-04 7 0.1183927E-06 8 0.1747787E-10 9 0.1408431E-11 v, j, mj = 0 7 -7 0 0.6563009E-13 1 0.1530730E-04 2 0.9807638E-05 3 0.2727042E-05 4 0.2491217E-06 5 0.2690439E-08 6 0.1094340E-10 7 0.5542118E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -6 0 0.4052722E-34 1 0.7327478E-07 2 0.4344201E-06 3 0.6330719E-06 4 0.9902449E-07 5 0.2132707E-08 6 0.3592817E-11 7 0.1593674E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -5 0 0.3612347E-07 1 0.7651615E-07 2 0.5005783E-06 3 0.4850977E-06 4 0.9813299E-07 5 0.3233230E-08 6 0.1627106E-10 7 0.1859859E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -4 0 0.1532830E-34 1 0.1112205E-08 2 0.7379432E-07 3 0.2229460E-06 4 0.1656004E-06 5 0.2206228E-07 6 0.7709771E-10 7 0.1360119E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -3 0 0.9845922E-16 1 0.1992962E-07 2 0.3129058E-07 3 0.2449982E-06 4 0.5077516E-06 5 0.5543910E-07 6 0.1628759E-09 7 0.4860285E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -2 0 0.6323706E-35 1 0.7185801E-07 2 0.1062146E-06 3 0.5269520E-06 4 0.7748362E-06 5 0.6820604E-07 6 0.1741121E-09 7 0.2371294E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 -1 0 0.3337124E-15 1 0.2005052E-06 2 0.4431169E-06 3 0.1045513E-05 4 0.7145957E-06 5 0.4310410E-07 6 0.8972507E-10 7 0.2478664E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 0 0 0.3369950E-34 1 0.3258809E-06 2 0.9848978E-06 3 0.2091688E-05 4 0.7700268E-06 5 0.2845731E-07 6 0.3221800E-10 7 0.1293872E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 1 0 0.1720958E-06 1 0.2559887E-05 2 0.4981285E-05 3 0.7093410E-06 4 0.3984731E-06 5 0.3115743E-07 6 0.7177464E-10 7 0.2308996E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 2 0 0.1826112E-33 1 0.6198000E-06 2 0.1526537E-05 3 0.3448205E-05 4 0.3393995E-05 5 0.2184217E-06 6 0.4653390E-09 7 0.1861529E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 3 0 0.4922599E-16 1 0.7967047E-06 2 0.2617500E-06 3 0.4000138E-05 4 0.4013362E-05 5 0.2666314E-06 6 0.5543980E-09 7 0.3736511E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 4 0 0.9389718E-34 1 0.1087130E-06 2 0.9349461E-07 3 0.2355370E-05 4 0.2722494E-05 5 0.2024898E-06 6 0.4706090E-09 7 0.8980252E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 5 0 0.1021104E-14 1 0.2509226E-06 2 0.1035679E-05 3 0.2060587E-05 4 0.9392412E-06 5 0.7425522E-07 6 0.1990003E-09 7 0.8377862E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 6 0 0.1476446E-33 1 0.3398382E-06 2 0.4423718E-05 3 0.2327542E-05 4 0.4300498E-06 5 0.1103872E-07 6 0.3467769E-10 7 0.3687295E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 7 7 0 0.2865576E-04 1 0.2539351E-04 2 0.2500993E-04 3 0.5679352E-05 4 0.5101690E-06 5 0.4471081E-08 6 0.1907280E-10 7 0.1415073E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -9 0 0.6583315E-16 1 0.3341197E-12 2 0.6207377E-13 3 0.7936460E-13 4 0.1330263E-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 9 -8 0 0.2837505E-34 1 0.1401217E-13 2 0.1250948E-12 3 0.1000634E-12 4 0.1073344E-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 9 -7 0 0.1255353E-17 1 0.1736522E-12 2 0.6620212E-13 3 0.3640317E-13 4 0.2876616E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -6 0 0.3749462E-34 1 0.6224768E-13 2 0.6890099E-14 3 0.3098309E-13 4 0.2395454E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -5 0 0.1432438E-13 1 0.1656997E-13 2 0.9083888E-13 3 0.4837487E-13 4 0.3067569E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -4 0 0.8567840E-35 1 0.1550842E-13 2 0.1658049E-12 3 0.3326968E-13 4 0.3944857E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -3 0 0.4004509E-16 1 0.1927957E-13 2 0.1947417E-13 3 0.2810296E-13 4 0.1392254E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -2 0 0.4488824E-34 1 0.2013600E-12 2 0.5320755E-13 3 0.2989999E-14 4 0.1794405E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -1 0 0.5999809E-17 1 0.2767819E-12 2 0.1276707E-12 3 0.3187582E-13 4 0.2242903E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 0 0 0.1424650E-34 1 0.3327594E-11 2 0.2273348E-12 3 0.2727910E-13 4 0.2226540E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 1 0 0.7357243E-11 1 0.1836376E-11 2 0.5481378E-12 3 0.6442985E-13 4 0.4870025E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 2 0 0.1737412E-34 1 0.6478958E-11 2 0.2231149E-12 3 0.4199607E-13 4 0.4341331E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 3 0 0.3561666E-17 1 0.1323135E-11 2 0.2956007E-12 3 0.1003521E-12 4 0.8862897E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 4 0 0.8818501E-35 1 0.2999875E-12 2 0.2011168E-12 3 0.1227155E-12 4 0.7466734E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 5 0 0.6351545E-17 1 0.4634242E-13 2 0.1962073E-12 3 0.2015527E-12 4 0.9312397E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 6 0 0.5908454E-34 1 0.2401034E-12 2 0.1842696E-12 3 0.1327715E-12 4 0.3637016E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 7 0 0.2014654E-12 1 0.1995699E-13 2 0.2122677E-12 3 0.2084285E-12 4 0.5507923E-13 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 8 0 0.5023728E-34 1 0.5356379E-13 2 0.1156570E-12 3 0.1235554E-12 4 0.1302804E-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 9 9 0 0.8002844E-16 1 0.2199785E-11 2 0.2441941E-11 3 0.2121975E-12 4 0.3083078E-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 1 -1 0 0.1725721E-11 1 0.9449476E-06 2 0.4061464E-06 3 0.3039893E-07 4 0.3005444E-09 5 0.3576450E-10 6 0.4013402E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 0 0 0.1330678E-33 1 0.1962556E-08 2 0.2217753E-07 3 0.2847219E-08 4 0.8447867E-10 5 0.1039074E-10 6 0.4534762E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 1 0 0.2112796E-05 1 0.3036877E-05 2 0.1622880E-05 3 0.2578984E-07 4 0.9723232E-09 5 0.6716195E-10 6 0.5519505E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -3 0 0.1316749E-13 1 0.1152153E-08 2 0.3220427E-09 3 0.1216944E-09 4 0.2976925E-10 5 0.5927403E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -2 0 0.2020720E-33 1 0.2689974E-09 2 0.4876284E-11 3 0.1757328E-10 4 0.3026885E-11 5 0.2058397E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -1 0 0.7842503E-15 1 0.1748519E-09 2 0.1084387E-09 3 0.7246602E-11 4 0.5114593E-11 5 0.1435891E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 0 0 0.3379168E-34 1 0.2304427E-10 2 0.4298783E-10 3 0.3772919E-11 4 0.4733084E-11 5 0.3721256E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 1 0 0.2247142E-09 1 0.9232684E-10 2 0.7088502E-10 3 0.2692635E-11 4 0.6636290E-11 5 0.2763536E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 2 0 0.7042317E-33 1 0.8709025E-11 2 0.3918971E-10 3 0.1812440E-10 4 0.1300365E-10 5 0.9085492E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 3 0 0.1672602E-15 1 0.6704381E-09 2 0.3162555E-09 3 0.1034277E-09 4 0.6655083E-10 5 0.1247115E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -5 0 0.3486584E-10 1 0.2411627E-10 2 0.1024436E-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 5 -4 0 0.1079519E-34 1 0.8569512E-12 2 0.5310472E-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 5 -3 0 0.2679164E-15 1 0.1350069E-12 2 0.1766431E-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 5 -2 0 0.4635919E-35 1 0.8578014E-12 2 0.2006517E-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 5 -1 0 0.4438159E-19 1 0.5286697E-12 2 0.1247321E-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 5 0 0 0.2877614E-34 1 0.1519852E-12 2 0.2211526E-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 5 1 0 0.2663530E-12 1 0.3252526E-12 2 0.3705052E-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 5 2 0 0.9742282E-35 1 0.1796167E-12 2 0.1245828E-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 5 3 0 0.2346398E-15 1 0.2047419E-12 2 0.2322273E-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 5 4 0 0.9158694E-34 1 0.5731439E-11 2 0.4643975E-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 5 5 0 0.2183555E-14 1 0.1797033E-10 2 0.3316549E-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 sum of the probabilities = 0.6885127 average vibrational energy (ev) = 0.000006 average rotational energy (ev) = 0.051338 average diffraction energy (ev) = 0.122110 the reaction probability = 0.3114873D+00 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.36050715D+01 trans energy = 0.85714286D+00 trans energy in z = 0.85714286D+00 total momentum = 0.15214181D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.4730237E+00 0.1658406E+00 0.6827288E-01 1 0.3239902E-02 0.2499597E-01 0.1617772E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.1116199E+00 0 37 1 0 0.2605561E-01 0 43 1 1 0.1091866E+00 0 21 3 -3 0.3532228E-01 0 26 3 -2 0.1237435E-01 0 32 3 -1 0.1367556E-01 0 38 3 0 0.4223967E-02 0 44 3 1 0.2018618E-01 0 49 3 2 0.2525232E-01 0 54 3 3 0.5324388E-01 0 13 5 -5 0.1075755E-01 0 17 5 -4 0.4899287E-02 0 22 5 -3 0.3344474E-02 0 27 5 -2 0.1800654E-02 0 33 5 -1 0.1569602E-02 0 39 5 0 0.6064736E-03 0 45 5 1 0.1255110E-02 0 50 5 2 0.2845058E-02 0 55 5 3 0.5331719E-02 0 59 5 4 0.1016038E-01 0 63 5 5 0.1546761E-01 0 7 7 -7 0.1103991E-02 0 10 7 -6 0.4654626E-04 0 14 7 -5 0.4930032E-04 0 18 7 -4 0.1261469E-04 0 23 7 -3 0.1507251E-04 0 28 7 -2 0.2299348E-04 0 34 7 -1 0.2245540E-04 0 40 7 0 0.2673005E-04 0 46 7 1 0.5602341E-04 0 51 7 2 0.6902324E-04 0 56 7 3 0.8855173E-04 0 60 7 4 0.5999761E-04 0 64 7 5 0.9237000E-04 0 67 7 6 0.1589143E-03 0 70 7 7 0.2020449E-02 0 3 9 -9 0.4672110E-07 0 5 9 -8 0.5553931E-09 0 8 9 -7 0.1821295E-08 0 11 9 -6 0.1917349E-09 0 15 9 -5 0.1740835E-09 0 19 9 -4 0.1115264E-09 0 24 9 -3 0.3577522E-09 0 29 9 -2 0.1057650E-08 0 35 9 -1 0.3032102E-08 0 41 9 0 0.5805997E-08 0 47 9 1 0.1076796E-07 0 52 9 2 0.1058969E-07 0 57 9 3 0.7961813E-08 0 61 9 4 0.3387256E-08 0 65 9 5 0.1207268E-08 0 68 9 6 0.5113263E-09 0 71 9 7 0.4497189E-08 0 73 9 8 0.8703195E-09 0 75 9 9 0.7151583E-07 0 1 11 -11 0.0000000E+00 0 2 11 -10 0.0000000E+00 0 4 11 -9 0.0000000E+00 0 6 11 -8 0.0000000E+00 0 9 11 -7 0.0000000E+00 0 12 11 -6 0.0000000E+00 0 16 11 -5 0.0000000E+00 0 20 11 -4 0.0000000E+00 0 25 11 -3 0.0000000E+00 0 30 11 -2 0.0000000E+00 0 36 11 -1 0.0000000E+00 0 42 11 0 0.0000000E+00 0 48 11 1 0.0000000E+00 0 53 11 2 0.0000000E+00 0 58 11 3 0.0000000E+00 0 62 11 4 0.0000000E+00 0 66 11 5 0.0000000E+00 0 69 11 6 0.0000000E+00 0 72 11 7 0.0000000E+00 0 74 11 8 0.0000000E+00 0 76 11 9 0.0000000E+00 0 77 11 10 0.0000000E+00 0 78 11 11 0.0000000E+00 1 31 1 -1 0.8859743E-03 1 37 1 0 0.2044169E-04 1 43 1 1 0.2273337E-02 1 21 3 -3 0.3409797E-04 1 26 3 -2 0.4123092E-05 1 32 3 -1 0.2490780E-05 1 38 3 0 0.6063987E-06 1 44 3 1 0.2771033E-05 1 49 3 2 0.1830741E-05 1 54 3 3 0.1422188E-04 1 13 5 -5 0.5953975E-08 1 17 5 -4 0.3122393E-10 1 22 5 -3 0.3261101E-10 1 27 5 -2 0.6868799E-11 1 33 5 -1 0.5727244E-11 1 39 5 0 0.3382643E-11 1 45 5 1 0.4504247E-10 1 50 5 2 0.7062711E-11 1 55 5 3 0.2361460E-10 1 59 5 4 0.1719192E-09 1 63 5 5 0.1233693E-08 1 7 7 -7 0.0000000E+00 1 10 7 -6 0.0000000E+00 1 14 7 -5 0.0000000E+00 1 18 7 -4 0.0000000E+00 1 23 7 -3 0.0000000E+00 1 28 7 -2 0.0000000E+00 1 34 7 -1 0.0000000E+00 1 40 7 0 0.0000000E+00 1 46 7 1 0.0000000E+00 1 51 7 2 0.0000000E+00 1 56 7 3 0.0000000E+00 1 60 7 4 0.0000000E+00 1 64 7 5 0.0000000E+00 1 67 7 6 0.0000000E+00 1 70 7 7 0.0000000E+00 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.0000000E+00 2 37 1 0 0.0000000E+00 2 43 1 1 0.0000000E+00 2 21 3 -3 0.0000000E+00 2 26 3 -2 0.0000000E+00 2 32 3 -1 0.0000000E+00 2 38 3 0 0.0000000E+00 2 44 3 1 0.0000000E+00 2 49 3 2 0.0000000E+00 2 54 3 3 0.0000000E+00 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.5959812E-10 1 0.5496909E-04 2 0.1895713E-02 3 0.1061802E-01 4 0.1971011E-01 5 0.1285938E-01 6 0.4463462E-01 7 0.2074203E-01 8 0.1099227E-02 9 0.5808347E-05 v, j, mj = 0 1 0 0 0.1133807E-33 1 0.6500795E-03 2 0.1962790E-02 3 0.2911304E-02 4 0.5971398E-02 5 0.6031128E-02 6 0.7066059E-02 7 0.1414427E-02 8 0.4819161E-04 9 0.2319010E-06 v, j, mj = 0 1 1 0 0.2105102E-02 1 0.2094090E-02 2 0.7108863E-02 3 0.1582890E-01 4 0.2165455E-01 5 0.1492966E-01 6 0.2941661E-01 7 0.1520674E-01 8 0.8367416E-03 9 0.5315065E-05 v, j, mj = 0 3 -3 0 0.5024065E-10 1 0.3425740E-03 2 0.6009157E-03 3 0.4482129E-02 4 0.6663834E-02 5 0.1004115E-01 6 0.1093113E-01 7 0.2198184E-02 8 0.6219678E-04 9 0.1688843E-06 v, j, mj = 0 3 -2 0 0.2296758E-32 1 0.9168659E-03 2 0.4590469E-03 3 0.1280973E-02 4 0.2282148E-02 5 0.4776571E-02 6 0.2471045E-02 7 0.1848122E-03 8 0.2877712E-05 9 0.1450021E-07 v, j, mj = 0 3 -1 0 0.7071502E-11 1 0.7984043E-03 2 0.4622867E-03 3 0.1098642E-02 4 0.2132499E-02 5 0.3529568E-02 6 0.4599882E-02 7 0.1026421E-02 8 0.2775837E-04 9 0.9586959E-07 v, j, mj = 0 3 0 0 0.4770789E-33 1 0.8306160E-04 2 0.7060642E-03 3 0.3287190E-03 4 0.4092726E-03 5 0.1024231E-02 6 0.1398251E-02 7 0.2652074E-03 8 0.9126458E-05 9 0.3339997E-07 v, j, mj = 0 3 1 0 0.8009427E-03 1 0.2220388E-03 2 0.2514756E-02 3 0.1363197E-02 4 0.2784971E-02 5 0.6275863E-02 6 0.5400647E-02 7 0.8082139E-03 8 0.1552725E-04 9 0.2218254E-07 v, j, mj = 0 3 2 0 0.2676580E-33 1 0.9440365E-03 2 0.9184029E-03 3 0.2420123E-02 4 0.5339481E-02 5 0.1021261E-01 6 0.4741751E-02 7 0.6598625E-03 8 0.1599845E-04 9 0.4910116E-07 v, j, mj = 0 3 3 0 0.4644342E-10 1 0.1006889E-02 2 0.1389342E-02 3 0.5211060E-02 4 0.7669624E-02 5 0.1444372E-01 6 0.1986638E-01 7 0.3567968E-02 8 0.8871883E-04 9 0.1843195E-06 v, j, mj = 0 5 -5 0 0.9247228E-03 1 0.6389897E-03 2 0.3686144E-02 3 0.1254040E-02 4 0.2946405E-02 5 0.1114470E-02 6 0.1873817E-03 7 0.5357486E-05 8 0.4040501E-07 9 0.1760149E-10 v, j, mj = 0 5 -4 0 0.4973925E-33 1 0.2950314E-03 2 0.1638409E-02 3 0.1295065E-02 4 0.1176174E-02 5 0.4279257E-03 6 0.6083943E-04 7 0.5766386E-05 8 0.7608540E-07 9 0.1050499E-10 v, j, mj = 0 5 -3 0 0.2178752E-11 1 0.2791516E-03 2 0.4862031E-03 3 0.6815421E-03 4 0.8771400E-03 5 0.7026661E-03 6 0.2890782E-03 7 0.2845944E-04 8 0.2338401E-06 9 0.3815812E-10 v, j, mj = 0 5 -2 0 0.7034171E-33 1 0.1090476E-03 2 0.6490697E-04 3 0.2224885E-03 4 0.2754453E-03 5 0.5939951E-03 6 0.4873874E-03 7 0.4703079E-04 8 0.3518705E-06 9 0.4656460E-10 v, j, mj = 0 5 -1 0 0.7745930E-12 1 0.4148042E-04 2 0.5138823E-04 3 0.1907668E-03 4 0.8835263E-04 5 0.6579004E-03 6 0.4992685E-03 7 0.4016845E-04 8 0.2761560E-06 9 0.3122384E-10 v, j, mj = 0 5 0 0 0.2024256E-33 1 0.4364233E-06 2 0.5877850E-04 3 0.6881877E-04 4 0.9774044E-04 5 0.2742677E-03 6 0.1005377E-03 7 0.5854334E-05 8 0.3964095E-07 9 0.2859212E-11 v, j, mj = 0 5 1 0 0.1989754E-04 1 0.8168138E-04 2 0.4015993E-03 3 0.2353207E-03 4 0.1731210E-03 5 0.2415540E-03 6 0.9683909E-04 7 0.5064963E-05 8 0.3216358E-07 9 0.1315212E-10 v, j, mj = 0 5 2 0 0.3874604E-33 1 0.7558214E-06 2 0.1055964E-03 3 0.2206338E-03 4 0.4492005E-03 5 0.1375631E-02 6 0.6554759E-03 7 0.3759578E-04 8 0.1688186E-06 9 0.1490850E-10 v, j, mj = 0 5 3 0 0.1790616E-11 1 0.1148109E-03 2 0.3133151E-03 3 0.8552980E-03 4 0.1163859E-02 5 0.2133988E-02 6 0.7151886E-03 7 0.3507894E-04 8 0.1799468E-06 9 0.2084599E-10 v, j, mj = 0 5 4 0 0.6607097E-33 1 0.4057346E-03 2 0.1442693E-02 3 0.2399316E-02 4 0.3826580E-02 5 0.1701622E-02 6 0.3687258E-03 7 0.1567122E-04 8 0.3393389E-07 9 0.2125615E-11 v, j, mj = 0 5 5 0 0.1263449E-10 1 0.1956395E-02 2 0.2521074E-02 3 0.5615819E-02 4 0.2518715E-02 5 0.2289976E-02 6 0.5357332E-03 7 0.2971620E-04 8 0.1805085E-06 9 0.2528062E-10 v, j, mj = 0 7 -7 0 0.4213173E-12 1 0.6042356E-03 2 0.3437261E-03 3 0.1362689E-03 4 0.1814144E-04 5 0.1595284E-05 6 0.2356312E-07 7 0.1779323E-10 8 0.5285339E-12 9 0.0000000E+00 v, j, mj = 0 7 -6 0 0.6858927E-34 1 0.4232609E-05 2 0.1910453E-04 3 0.1723059E-04 4 0.5264964E-05 5 0.6925366E-06 6 0.2096864E-07 7 0.5547655E-10 8 0.1769621E-12 9 0.0000000E+00 v, j, mj = 0 7 -5 0 0.6336623E-05 1 0.8107883E-05 2 0.1324656E-04 3 0.1391618E-04 4 0.6771201E-05 5 0.8625379E-06 6 0.5908996E-07 7 0.2485461E-09 8 0.2636339E-12 9 0.0000000E+00 v, j, mj = 0 7 -4 0 0.3056459E-34 1 0.1922508E-07 2 0.2357130E-05 3 0.3928980E-05 4 0.3344882E-05 5 0.2674003E-05 6 0.2894402E-06 7 0.1033696E-08 8 0.3698419E-12 9 0.0000000E+00 v, j, mj = 0 7 -3 0 0.9891329E-13 1 0.1381816E-05 2 0.1831120E-05 3 0.6786484E-06 4 0.3947805E-05 5 0.6640125E-05 6 0.5912286E-06 7 0.1762847E-08 8 0.2625247E-12 9 0.0000000E+00 v, j, mj = 0 7 -2 0 0.1498494E-34 1 0.2398158E-05 2 0.1620776E-05 3 0.2585379E-05 4 0.6507531E-05 5 0.9229730E-05 6 0.6502166E-06 7 0.1684509E-08 8 0.1799217E-12 9 0.0000000E+00 v, j, mj = 0 7 -1 0 0.4361549E-14 1 0.1803831E-05 2 0.2501567E-05 3 0.4769915E-05 4 0.7047732E-05 5 0.5995538E-05 6 0.3360475E-06 7 0.7683484E-09 8 0.1258474E-12 9 0.0000000E+00 v, j, mj = 0 7 0 0 0.4766921E-34 1 0.5971136E-06 2 0.3253193E-05 3 0.6229002E-05 4 0.1233699E-04 5 0.4199994E-05 6 0.1136407E-06 7 0.1212918E-09 8 0.1194119E-12 9 0.0000000E+00 v, j, mj = 0 7 1 0 0.4178019E-05 1 0.8306861E-05 2 0.1542491E-04 3 0.2284625E-04 4 0.3714871E-05 5 0.1442579E-05 6 0.1096297E-06 7 0.2906892E-09 8 0.1911751E-12 9 0.0000000E+00 v, j, mj = 0 7 2 0 0.1202422E-33 1 0.1490312E-06 2 0.1328716E-04 3 0.8843483E-05 4 0.2342233E-04 5 0.2211109E-04 6 0.1207523E-05 7 0.2613235E-08 8 0.2415384E-12 9 0.0000000E+00 v, j, mj = 0 7 3 0 0.5459550E-13 1 0.8515089E-05 2 0.9025527E-05 3 0.9202504E-05 4 0.3233597E-04 5 0.2793078E-04 6 0.1538411E-05 7 0.3446581E-08 8 0.7461270E-13 9 0.0000000E+00 v, j, mj = 0 7 4 0 0.8340970E-34 1 0.2440159E-05 2 0.3463132E-05 3 0.6016417E-05 4 0.2484045E-04 5 0.2180747E-04 6 0.1426691E-05 7 0.3293918E-08 8 0.6576636E-12 9 0.0000000E+00 v, j, mj = 0 7 5 0 0.1128248E-11 1 0.1032975E-04 2 0.2093281E-04 3 0.3023689E-04 4 0.2201309E-04 5 0.8301283E-05 6 0.5546669E-06 7 0.1513464E-08 8 0.5459719E-12 9 0.0000000E+00 v, j, mj = 0 7 6 0 0.2708816E-33 1 0.3026233E-05 2 0.8013390E-04 3 0.4747214E-04 4 0.2558330E-04 5 0.2584184E-05 6 0.1142388E-06 7 0.2903815E-09 8 0.5921765E-12 9 0.0000000E+00 v, j, mj = 0 7 7 0 0.4791110E-03 1 0.3604535E-03 2 0.1051445E-02 3 0.7027475E-04 4 0.5615048E-04 5 0.2975737E-05 6 0.3908963E-07 7 0.8331267E-10 8 0.1003242E-11 9 0.0000000E+00 v, j, mj = 0 9 -9 0 0.1172363E-14 1 0.3320610E-07 2 0.1273704E-07 3 0.7718401E-09 4 0.5622922E-11 5 0.3088618E-12 6 0.1855889E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -8 0 0.4324271E-34 1 0.4401011E-09 2 0.8265264E-10 3 0.3058850E-10 4 0.1876902E-11 5 0.1385937E-12 6 0.3540550E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -7 0 0.6471490E-16 1 0.8927843E-09 2 0.7772473E-09 3 0.1480617E-09 4 0.3037094E-11 5 0.1438250E-12 6 0.2111817E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -6 0 0.6414091E-35 1 0.3447277E-10 2 0.1131407E-09 3 0.4227370E-10 4 0.1794998E-11 5 0.2214733E-13 6 0.3054102E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -5 0 0.4117534E-10 1 0.1506415E-10 2 0.6552958E-10 3 0.4995459E-10 4 0.2215528E-11 5 0.1250450E-12 6 0.1927665E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -4 0 0.8860830E-35 1 0.1010262E-10 2 0.4476997E-10 3 0.4954338E-10 4 0.7013517E-11 5 0.8409405E-13 6 0.1278348E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -3 0 0.2232929E-15 1 0.2413626E-10 2 0.1415156E-09 3 0.1752667E-09 4 0.1671582E-10 5 0.9525287E-13 6 0.2231712E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -2 0 0.1415144E-34 1 0.1375096E-09 2 0.5270295E-09 3 0.3706814E-09 4 0.2228750E-10 5 0.1230825E-12 6 0.1873804E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -1 0 0.3114206E-16 1 0.7789112E-09 2 0.1580655E-08 3 0.6414992E-09 4 0.3093352E-10 5 0.9298062E-13 6 0.9791872E-14 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 0 0 0.7560538E-35 1 0.3004347E-08 2 0.2089102E-08 3 0.6844943E-09 4 0.2801193E-10 5 0.3073158E-13 6 0.9922428E-14 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 1 0 0.3498805E-08 1 0.4196748E-08 2 0.2729856E-08 3 0.3376184E-09 4 0.4704057E-11 5 0.1619228E-12 6 0.6861649E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 2 0 0.3436999E-34 1 0.4859371E-08 2 0.4334002E-08 3 0.1326354E-08 4 0.6966086E-10 5 0.2493841E-12 6 0.5352791E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 3 0 0.1721450E-16 1 0.2121446E-08 2 0.3712569E-08 3 0.1980463E-08 4 0.1469441E-09 5 0.3533176E-12 6 0.3842376E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 4 0 0.6087163E-35 1 0.2718331E-09 2 0.1427543E-08 3 0.1551365E-08 4 0.1358943E-09 5 0.5928016E-12 6 0.2724565E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 5 0 0.5635314E-16 1 0.1424182E-09 2 0.4143727E-09 3 0.5894192E-09 4 0.6060425E-10 5 0.3715875E-12 6 0.8208989E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 6 0 0.3025720E-34 1 0.2598000E-10 2 0.2599942E-09 3 0.2116790E-09 4 0.1314312E-10 5 0.4936763E-12 6 0.3640883E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 7 0 0.8159367E-09 1 0.1471707E-08 2 0.1853994E-08 3 0.3516930E-09 4 0.3612739E-11 5 0.1835937E-12 6 0.6105746E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 8 0 0.1760295E-34 1 0.2483298E-10 2 0.6683381E-09 3 0.1704299E-09 4 0.6272694E-11 5 0.3912298E-12 6 0.5458269E-13 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 9 0 0.1649392E-14 1 0.4844138E-07 2 0.2146758E-07 3 0.1593261E-08 4 0.1223006E-10 5 0.1099133E-11 6 0.2772156E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 -1 0 0.7790002E-09 1 0.4206768E-03 2 0.1625649E-03 3 0.2924628E-03 4 0.9956809E-05 5 0.3120702E-06 6 0.7173834E-10 7 0.2293752E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 0 0 0.5258866E-32 1 0.1485697E-05 2 0.1662758E-04 3 0.1961605E-05 4 0.3537090E-06 5 0.1309221E-07 6 0.5501745E-11 7 0.6084181E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 1 0 0.3667794E-03 1 0.3981897E-03 2 0.1435585E-02 3 0.3516176E-04 4 0.3745241E-04 5 0.1686113E-06 6 0.1016978E-09 7 0.2097404E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -3 0 0.4727769E-10 1 0.3770151E-05 2 0.1832802E-04 3 0.1195481E-04 4 0.4483340E-07 5 0.9867241E-10 6 0.7039734E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -2 0 0.6372306E-33 1 0.3561768E-05 2 0.4708560E-06 3 0.8297911E-07 4 0.7452925E-08 5 0.3047072E-10 6 0.5708243E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -1 0 0.1940822E-11 1 0.1766823E-05 2 0.5475105E-06 3 0.1741972E-06 4 0.2229044E-08 5 0.1332137E-10 6 0.4465353E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 0 0 0.6516184E-33 1 0.1805377E-07 2 0.5187318E-06 3 0.6699505E-07 4 0.2598696E-08 5 0.1786904E-10 6 0.1571476E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 1 0 0.2830425E-06 1 0.2555301E-06 2 0.2171634E-05 3 0.5083472E-07 4 0.9948697E-08 5 0.3816805E-10 6 0.4031368E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 2 0 0.1130848E-32 1 0.1004845E-07 2 0.1596475E-05 3 0.2156216E-06 4 0.8554643E-08 5 0.3278340E-10 6 0.8717047E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 3 0 0.1538760E-10 1 0.5108281E-05 2 0.6744053E-05 3 0.2295119E-05 4 0.7415511E-07 5 0.2243894E-09 6 0.3136959E-10 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -5 0 0.2822290E-08 1 0.2523186E-08 2 0.5585258E-09 3 0.3932803E-10 4 0.1064460E-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 5 -4 0 0.1890429E-33 1 0.7022297E-11 2 0.1640560E-10 3 0.2069825E-11 4 0.5726207E-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 5 -3 0 0.1754260E-14 1 0.2345779E-10 2 0.2038955E-11 3 0.4497380E-11 4 0.2615131E-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 5 -2 0 0.4478485E-35 1 0.1613725E-11 2 0.2566112E-11 3 0.2297017E-11 4 0.3919446E-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 5 -1 0 0.1405109E-17 1 0.2402564E-11 2 0.1769652E-11 3 0.9854512E-12 4 0.5695756E-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 5 0 0 0.1540071E-34 1 0.1245307E-11 2 0.1130333E-11 3 0.5158391E-12 4 0.4911647E-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 5 1 0 0.1171676E-10 1 0.2456294E-10 2 0.7162766E-11 3 0.6831838E-12 4 0.9168117E-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 5 2 0 0.2145450E-34 1 0.1901722E-11 2 0.2243051E-11 3 0.2587029E-11 4 0.3309075E-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 5 3 0 0.1697367E-14 1 0.1032398E-10 2 0.6118239E-11 3 0.6478066E-11 4 0.6926167E-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 5 4 0 0.1437527E-33 1 0.1114221E-09 2 0.4409454E-10 3 0.1408307E-10 4 0.2319437E-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 5 5 0 0.2223942E-13 1 0.8129368E-09 2 0.3142606E-09 3 0.9833807E-10 4 0.8135689E-11 5 0.0000000E+00 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 sum of the probabilities = 0.4762636 average vibrational energy (ev) = 0.003495 average rotational energy (ev) = 0.067918 average diffraction energy (ev) = 0.164882 the reaction probability = 0.5237364D+00 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.34907858D+01 trans energy = 0.97142857D+00 trans energy in z = 0.97142857D+00 total momentum = 0.16196732D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.3092390E+00 0.2037854E+00 0.9051174E-01 1 0.6243205E-02 0.6324478E-01 0.4584492E-01 2 0.0000000E+00 0.0000000E+00 0.0000000E+00 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.5616085E-01 0 37 1 0 0.1711702E-01 0 43 1 1 0.5155418E-01 0 21 3 -3 0.2239560E-01 0 26 3 -2 0.9796187E-02 0 32 3 -1 0.1217848E-01 0 38 3 0 0.4443811E-02 0 44 3 1 0.1914689E-01 0 49 3 2 0.2038967E-01 0 54 3 3 0.3285997E-01 0 13 5 -5 0.6598508E-02 0 17 5 -4 0.6274009E-02 0 22 5 -3 0.5547928E-02 0 27 5 -2 0.3043531E-02 0 33 5 -1 0.1924050E-02 0 39 5 0 0.6368957E-03 0 45 5 1 0.1706559E-02 0 50 5 2 0.3252350E-02 0 55 5 3 0.6841467E-02 0 59 5 4 0.9708846E-02 0 63 5 5 0.8396147E-02 0 7 7 -7 0.1408440E-02 0 10 7 -6 0.6244781E-03 0 14 7 -5 0.5438617E-03 0 18 7 -4 0.1553250E-03 0 23 7 -3 0.1158036E-03 0 28 7 -2 0.1608431E-03 0 34 7 -1 0.8374594E-04 0 40 7 0 0.8705060E-04 0 46 7 1 0.2549241E-03 0 51 7 2 0.2405118E-03 0 56 7 3 0.3563546E-03 0 60 7 4 0.4900083E-03 0 64 7 5 0.6496024E-03 0 67 7 6 0.1670429E-02 0 70 7 7 0.2263389E-02 0 3 9 -9 0.5691643E-04 0 5 9 -8 0.8339451E-06 0 8 9 -7 0.2253911E-05 0 11 9 -6 0.2111843E-06 0 15 9 -5 0.2687691E-06 0 19 9 -4 0.6863254E-07 0 24 9 -3 0.8192952E-07 0 29 9 -2 0.2550362E-06 0 35 9 -1 0.2498488E-06 0 41 9 0 0.2715849E-06 0 47 9 1 0.9389497E-06 0 52 9 2 0.5136150E-06 0 57 9 3 0.5878580E-06 0 61 9 4 0.7451145E-06 0 65 9 5 0.5481331E-06 0 68 9 6 0.3011346E-06 0 71 9 7 0.3837576E-05 0 73 9 8 0.1990696E-05 0 75 9 9 0.9042693E-04 0 1 11 -11 0.6530381E-12 0 2 11 -10 0.2204785E-12 0 4 11 -9 0.1748323E-12 0 6 11 -8 0.1059527E-12 0 9 11 -7 0.6556480E-13 0 12 11 -6 0.1025880E-13 0 16 11 -5 0.1490475E-13 0 20 11 -4 0.5500821E-14 0 25 11 -3 0.1349313E-13 0 30 11 -2 0.1758936E-13 0 36 11 -1 0.1623615E-13 0 42 11 0 0.1836817E-13 0 48 11 1 0.8283065E-13 0 53 11 2 0.2506676E-13 0 58 11 3 0.1469980E-13 0 62 11 4 0.1432259E-13 0 66 11 5 0.2606585E-13 0 69 11 6 0.1694873E-13 0 72 11 7 0.1353117E-12 0 74 11 8 0.1089469E-12 0 76 11 9 0.2182966E-12 0 77 11 10 0.3719176E-12 0 78 11 11 0.1235594E-11 1 31 1 -1 0.1348755E-02 1 37 1 0 0.1810971E-03 1 43 1 1 0.2830626E-02 1 21 3 -3 0.5029713E-03 1 26 3 -2 0.1200283E-03 1 32 3 -1 0.1264539E-03 1 38 3 0 0.2471757E-04 1 44 3 1 0.2121458E-03 1 49 3 2 0.6693631E-04 1 54 3 3 0.3994179E-03 1 13 5 -5 0.2742509E-03 1 17 5 -4 0.2126340E-05 1 22 5 -3 0.1546526E-05 1 27 5 -2 0.9125603E-06 1 33 5 -1 0.2474964E-06 1 39 5 0 0.9284436E-07 1 45 5 1 0.1022565E-05 1 50 5 2 0.1711275E-06 1 55 5 3 0.1022781E-05 1 59 5 4 0.2900846E-04 1 63 5 5 0.1196500E-03 1 7 7 -7 0.2986223E-08 1 10 7 -6 0.9200487E-10 1 14 7 -5 0.2643167E-10 1 18 7 -4 0.8822079E-12 1 23 7 -3 0.1645913E-11 1 28 7 -2 0.4920192E-12 1 34 7 -1 0.4939556E-12 1 40 7 0 0.1111875E-12 1 46 7 1 0.1648289E-11 1 51 7 2 0.2084818E-12 1 56 7 3 0.1390286E-11 1 60 7 4 0.3191195E-11 1 64 7 5 0.1948291E-11 1 67 7 6 0.1699406E-10 1 70 7 7 0.1373333E-08 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.0000000E+00 2 37 1 0 0.0000000E+00 2 43 1 1 0.0000000E+00 2 21 3 -3 0.0000000E+00 2 26 3 -2 0.0000000E+00 2 32 3 -1 0.0000000E+00 2 38 3 0 0.0000000E+00 2 44 3 1 0.0000000E+00 2 49 3 2 0.0000000E+00 2 54 3 3 0.0000000E+00 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.5576647E-10 1 0.1196228E-03 2 0.2446507E-03 3 0.2035171E-02 4 0.4260752E-02 5 0.1068217E-01 6 0.9107334E-02 7 0.2438214E-01 8 0.5209063E-02 9 0.1199478E-03 v, j, mj = 0 1 0 0 0.3699559E-32 1 0.4392442E-03 2 0.9088305E-04 3 0.1182978E-02 4 0.2755444E-02 5 0.4846594E-02 6 0.4561302E-02 7 0.2964889E-02 8 0.2722052E-03 9 0.3482250E-05 v, j, mj = 0 1 1 0 0.1211196E-02 1 0.2165274E-02 2 0.3832930E-02 3 0.1972447E-02 4 0.9710532E-02 5 0.1014265E-01 6 0.4766300E-02 7 0.1412808E-01 8 0.3540738E-02 9 0.8403403E-04 v, j, mj = 0 3 -3 0 0.4726488E-10 1 0.7412329E-05 2 0.5106489E-03 3 0.1669160E-02 4 0.1011690E-02 5 0.3287579E-02 6 0.7871271E-02 7 0.7179505E-02 8 0.8466936E-03 9 0.1164504E-04 v, j, mj = 0 3 -2 0 0.3160164E-32 1 0.7651112E-03 2 0.1281191E-02 3 0.4192933E-03 4 0.9136587E-03 5 0.1997374E-02 6 0.3401026E-02 7 0.9619763E-03 8 0.5602355E-04 9 0.5341061E-06 v, j, mj = 0 3 -1 0 0.4413265E-10 1 0.6680119E-03 2 0.2996863E-03 3 0.7936146E-03 4 0.1519315E-02 5 0.2074237E-02 6 0.3893991E-02 7 0.2701717E-02 8 0.2259250E-03 9 0.1986170E-05 v, j, mj = 0 3 0 0 0.3501298E-33 1 0.1333978E-03 2 0.1116503E-03 3 0.3772024E-03 4 0.6827610E-03 5 0.5865074E-03 6 0.1719505E-02 7 0.7800287E-03 8 0.5193514E-04 9 0.8231530E-06 v, j, mj = 0 3 1 0 0.9564208E-04 1 0.8183815E-03 2 0.1165676E-02 3 0.1795549E-02 4 0.2389242E-02 5 0.3466501E-02 6 0.5549308E-02 7 0.3461779E-02 8 0.3993407E-03 9 0.5467484E-05 v, j, mj = 0 3 2 0 0.8962404E-33 1 0.3828358E-03 2 0.1680978E-02 3 0.9116127E-03 4 0.1475993E-02 5 0.6487666E-02 6 0.6939758E-02 7 0.2278951E-02 8 0.2285849E-03 9 0.3290814E-05 v, j, mj = 0 3 3 0 0.5640125E-10 1 0.7713249E-03 2 0.5970265E-03 3 0.1316437E-02 4 0.3983623E-02 5 0.2961516E-02 6 0.1213177E-01 7 0.9996094E-02 8 0.1087853E-02 9 0.1431847E-04 v, j, mj = 0 5 -5 0 0.1731621E-03 1 0.1443082E-03 2 0.1123493E-02 3 0.6096666E-03 4 0.1689770E-02 5 0.1466892E-02 6 0.1237011E-02 7 0.1492873E-03 8 0.4893860E-05 9 0.2538612E-07 v, j, mj = 0 5 -4 0 0.4239554E-33 1 0.2909772E-03 2 0.1191286E-02 3 0.1096560E-02 4 0.1881010E-02 5 0.1436566E-02 6 0.3188388E-03 7 0.5419031E-04 8 0.4563696E-05 9 0.1718679E-07 v, j, mj = 0 5 -3 0 0.6927605E-11 1 0.2507443E-03 2 0.2061640E-03 3 0.1316798E-02 4 0.1368716E-02 5 0.1492189E-02 6 0.7104635E-03 7 0.1932193E-03 8 0.9592772E-05 9 0.4093782E-07 v, j, mj = 0 5 -2 0 0.2587825E-33 1 0.9733931E-04 2 0.9392311E-04 3 0.3585896E-03 4 0.4285045E-03 5 0.5936247E-03 6 0.1046513E-02 7 0.4046306E-03 8 0.2033031E-04 9 0.7613602E-07 v, j, mj = 0 5 -1 0 0.1618186E-12 1 0.5185139E-04 2 0.5367113E-04 3 0.1585238E-03 4 0.1499366E-03 5 0.3038114E-03 6 0.8891498E-03 7 0.3045780E-03 8 0.1248556E-04 9 0.4251585E-07 v, j, mj = 0 5 0 0 0.2784311E-33 1 0.3075033E-05 2 0.2514253E-04 3 0.4704903E-04 4 0.7759731E-04 5 0.1424632E-03 6 0.2759859E-03 7 0.6344856E-04 8 0.2129642E-05 9 0.4504259E-08 v, j, mj = 0 5 1 0 0.1347070E-03 1 0.1503459E-03 2 0.4936379E-03 3 0.3260098E-03 4 0.2878710E-03 5 0.1185217E-03 6 0.1443604E-03 7 0.4795949E-04 8 0.3128016E-05 9 0.1810850E-07 v, j, mj = 0 5 2 0 0.2423644E-32 1 0.5034566E-05 2 0.1464636E-03 3 0.1662012E-03 4 0.2374654E-03 5 0.9552774E-03 6 0.1423502E-02 7 0.3109233E-03 8 0.7465761E-05 9 0.1703762E-07 v, j, mj = 0 5 3 0 0.2352441E-11 1 0.9990864E-04 2 0.2549050E-03 3 0.9662199E-03 4 0.1154587E-02 5 0.2184038E-02 6 0.1936269E-02 7 0.2401401E-03 8 0.5380107E-05 9 0.1968973E-07 v, j, mj = 0 5 4 0 0.7581565E-33 1 0.3512847E-03 2 0.7380391E-03 3 0.1077081E-02 4 0.3137036E-02 5 0.3281118E-02 6 0.1015063E-02 7 0.1080095E-03 8 0.1208969E-05 9 0.6046859E-08 v, j, mj = 0 5 5 0 0.2223833E-10 1 0.1015755E-03 2 0.4309141E-03 3 0.2044323E-02 4 0.1143537E-02 5 0.1820435E-02 6 0.2241095E-02 7 0.5922871E-03 8 0.2192786E-04 9 0.5351644E-07 v, j, mj = 0 7 -7 0 0.6193024E-11 1 0.4163429E-03 2 0.2958324E-03 3 0.4928174E-03 4 0.1498702E-03 5 0.4828361E-04 6 0.5254201E-05 7 0.3912232E-07 8 0.2745190E-10 9 0.4845115E-12 v, j, mj = 0 7 -6 0 0.2628572E-33 1 0.9406265E-04 2 0.1416458E-03 3 0.2872493E-03 4 0.7224973E-04 5 0.2723309E-04 6 0.1949572E-05 7 0.8779939E-07 8 0.1778547E-09 9 0.1379982E-12 v, j, mj = 0 7 -5 0 0.3776636E-04 1 0.3678112E-04 2 0.2535369E-03 3 0.9161227E-04 4 0.9730048E-04 5 0.2256292E-04 6 0.4064005E-05 7 0.2371154E-06 8 0.5555190E-09 9 0.2110940E-12 v, j, mj = 0 7 -4 0 0.1369322E-33 1 0.1131856E-05 2 0.4267224E-04 3 0.3756063E-04 4 0.3512555E-04 5 0.2481279E-04 6 0.1313749E-04 7 0.8826510E-06 8 0.1815795E-08 9 0.3005227E-12 v, j, mj = 0 7 -3 0 0.9764297E-11 1 0.1197180E-04 2 0.1093542E-04 3 0.1359280E-04 4 0.1552278E-04 5 0.3335386E-04 6 0.2890037E-04 7 0.1523855E-05 8 0.2673691E-08 9 0.2402063E-12 v, j, mj = 0 7 -2 0 0.1320349E-33 1 0.2581872E-04 2 0.1621913E-04 3 0.2953631E-04 4 0.8041708E-05 5 0.4581123E-04 6 0.3387685E-04 7 0.1536707E-05 8 0.2404187E-08 9 0.2656055E-12 v, j, mj = 0 7 -1 0 0.1083535E-12 1 0.2471015E-05 2 0.6379843E-05 3 0.1550811E-04 4 0.1084303E-04 5 0.3060332E-04 6 0.1727888E-04 7 0.6608038E-06 8 0.9407472E-09 9 0.1593836E-12 v, j, mj = 0 7 0 0 0.9471133E-35 1 0.3728974E-06 2 0.4500769E-05 3 0.1478454E-04 4 0.2251074E-04 5 0.3771114E-04 6 0.7036330E-05 7 0.1340770E-06 8 0.1044132E-09 9 0.5042455E-13 v, j, mj = 0 7 1 0 0.1515022E-04 1 0.7095358E-05 2 0.1417830E-03 3 0.2878398E-04 4 0.5168489E-04 5 0.7956937E-05 6 0.2362218E-05 7 0.1072739E-06 8 0.1672627E-09 9 0.9732978E-13 v, j, mj = 0 7 2 0 0.1523502E-33 1 0.3662656E-07 2 0.3247126E-04 3 0.3850276E-04 4 0.2640963E-04 5 0.9090796E-04 6 0.5040801E-04 7 0.1773298E-05 8 0.2296211E-08 9 0.1021892E-12 v, j, mj = 0 7 3 0 0.3607067E-11 1 0.2291101E-04 2 0.1988528E-04 3 0.7208735E-04 4 0.2803681E-04 5 0.1434537E-03 6 0.6753255E-04 7 0.2444402E-05 8 0.3569767E-08 9 0.6509841E-13 v, j, mj = 0 7 4 0 0.1733068E-34 1 0.7367047E-04 2 0.4753530E-04 3 0.1103228E-03 4 0.7346005E-04 5 0.1206199E-03 6 0.6196192E-04 7 0.2434463E-05 8 0.3333212E-08 9 0.2763083E-12 v, j, mj = 0 7 5 0 0.4316309E-12 1 0.8411648E-04 2 0.8312415E-04 3 0.2251968E-03 4 0.1422782E-03 5 0.9049823E-04 6 0.2329641E-04 7 0.1090340E-05 8 0.1873802E-08 9 0.1560511E-12 v, j, mj = 0 7 6 0 0.1787281E-33 1 0.1023219E-03 2 0.7336418E-03 3 0.4536788E-03 4 0.3106417E-03 5 0.6128312E-04 6 0.8607823E-05 7 0.2535613E-06 8 0.4171282E-09 9 0.2384620E-12 v, j, mj = 0 7 7 0 0.3287224E-03 1 0.1766264E-03 2 0.1074170E-02 3 0.1761645E-03 4 0.4039237E-03 5 0.9576104E-04 6 0.7866939E-05 7 0.1537776E-06 8 0.1834228E-09 9 0.1139914E-11 v, j, mj = 0 9 -9 0 0.5155150E-11 1 0.3551562E-04 2 0.1649846E-04 3 0.4842521E-05 4 0.5956783E-07 5 0.2608411E-09 6 0.6924557E-12 7 0.1247898E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -8 0 0.4931576E-34 1 0.3839421E-06 2 0.2552572E-06 3 0.1719394E-06 4 0.2256624E-07 5 0.2393537E-09 6 0.5999805E-12 7 0.1005456E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -7 0 0.3334708E-13 1 0.1392158E-05 2 0.6893992E-06 3 0.1565208E-06 4 0.1543205E-07 5 0.3999306E-09 6 0.8225753E-12 7 0.7594942E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -6 0 0.1529383E-34 1 0.3067568E-08 2 0.1362820E-06 3 0.6243263E-07 4 0.9107424E-08 5 0.2942280E-09 6 0.3554989E-12 7 0.5072915E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -5 0 0.6509956E-07 1 0.7145184E-07 2 0.1185599E-06 3 0.6896503E-08 4 0.6281028E-08 5 0.4772563E-09 6 0.2932152E-11 7 0.1042238E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -4 0 0.3813154E-34 1 0.4950738E-08 2 0.3719472E-07 3 0.1498447E-07 4 0.9734997E-08 5 0.1758575E-08 6 0.8864785E-11 7 0.1750254E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -3 0 0.6267730E-14 1 0.9649636E-08 2 0.2078659E-07 3 0.2530961E-07 4 0.2294347E-07 5 0.3227724E-08 6 0.1234025E-10 7 0.1511647E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -2 0 0.3765792E-35 1 0.1013728E-06 2 0.3109108E-07 3 0.8033858E-07 4 0.3900067E-07 5 0.3223707E-08 6 0.9204433E-11 7 0.6275109E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 -1 0 0.1607492E-14 1 0.2396561E-07 2 0.2048356E-07 3 0.1460105E-06 4 0.5649738E-07 5 0.2886718E-08 6 0.5049418E-11 7 0.2821659E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 0 0 0.4598833E-35 1 0.2811788E-07 2 0.9708232E-07 3 0.1051452E-06 4 0.3931583E-07 5 0.1918920E-08 6 0.4622604E-11 7 0.9211342E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 1 0 0.1094967E-06 1 0.4400071E-06 2 0.2695991E-06 3 0.9674088E-07 4 0.2259217E-07 5 0.5121488E-09 6 0.1462274E-11 7 0.3991032E-13 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 2 0 0.5140517E-34 1 0.2249872E-07 2 0.1607466E-06 3 0.2499481E-06 4 0.7499461E-07 5 0.5407422E-08 6 0.1947002E-10 7 0.1127838E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 3 0 0.1800111E-13 1 0.9750626E-07 2 0.7560539E-07 3 0.2519507E-06 4 0.1479838E-06 5 0.1476554E-07 6 0.4614254E-10 7 0.1027286E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 4 0 0.5851176E-34 1 0.3348556E-06 2 0.1138667E-06 3 0.1445521E-06 4 0.1355684E-06 5 0.1621461E-07 6 0.5691079E-10 7 0.2470956E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 5 0 0.5851337E-14 1 0.2624673E-06 2 0.1389038E-06 3 0.7326888E-07 4 0.6445245E-07 5 0.9006215E-08 6 0.3419093E-10 7 0.2925078E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 6 0 0.1454827E-33 1 0.1868559E-07 2 0.1745163E-06 3 0.7385488E-07 4 0.3195411E-07 5 0.2112010E-08 6 0.1136598E-10 7 0.3528755E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 7 0 0.1096660E-05 1 0.1073259E-05 2 0.1549817E-05 3 0.7831388E-07 4 0.3861077E-07 5 0.9134957E-09 6 0.1269707E-11 7 0.1798151E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 8 0 0.3263944E-33 1 0.1171070E-06 2 0.1564660E-05 3 0.2588799E-06 4 0.4915329E-07 5 0.8926580E-09 6 0.2464039E-11 7 0.2258313E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 9 9 0 0.4089255E-11 1 0.5295092E-04 2 0.2958342E-04 3 0.7744643E-05 4 0.1470475E-06 5 0.8911815E-09 6 0.2286925E-11 7 0.2950493E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -11 0 0.5858465E-13 1 0.1066177E-12 2 0.1363113E-12 3 0.3515244E-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 11 -10 0 0.6988861E-35 1 0.4578323E-13 2 0.7574722E-13 3 0.9894801E-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 11 -9 0 0.7892079E-16 1 0.5884386E-13 2 0.2681073E-13 3 0.8909880E-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 11 -8 0 0.2434629E-34 1 0.4517747E-13 2 0.3905257E-13 3 0.2172266E-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 11 -7 0 0.6756938E-16 1 0.1009385E-13 2 0.1744308E-13 3 0.3796029E-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 11 -6 0 0.5592977E-35 1 0.1459733E-14 2 0.2467254E-14 3 0.6331815E-14 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 11 -5 0 0.8999879E-15 1 0.4685816E-15 2 0.1000343E-13 3 0.3532755E-14 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 11 -4 0 0.2544180E-34 1 0.1137214E-15 2 0.2541085E-14 3 0.2846015E-14 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 11 -3 0 0.1503834E-16 1 0.8074911E-14 2 0.4848262E-14 3 0.5549140E-15 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 11 -2 0 0.4245039E-35 1 0.4839176E-14 2 0.4841080E-14 3 0.7909104E-14 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 11 -1 0 0.1603113E-16 1 0.1583253E-14 2 0.1003164E-13 3 0.4605226E-14 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 11 0 0 0.4140929E-34 1 0.1912398E-14 2 0.6637239E-14 3 0.9818532E-14 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 11 1 0 0.1049525E-13 1 0.7413773E-14 2 0.5510514E-13 3 0.9816488E-14 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 11 2 0 0.2862779E-34 1 0.2952267E-14 2 0.1509490E-13 3 0.7019591E-14 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 11 3 0 0.3407064E-16 1 0.4505732E-14 2 0.3697076E-14 3 0.6462919E-14 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 11 4 0 0.5329748E-34 1 0.2559948E-14 2 0.9769191E-15 3 0.1078572E-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 11 5 0 0.1382615E-16 1 0.1198249E-13 2 0.1115926E-13 3 0.2910279E-14 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 11 6 0 0.7337106E-35 1 0.5869742E-14 2 0.8926860E-14 3 0.2152127E-14 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 11 7 0 0.1436114E-13 1 0.5738930E-13 2 0.3668478E-13 3 0.2687648E-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 11 8 0 0.2047058E-34 1 0.1250253E-13 2 0.1820647E-13 3 0.7823793E-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 11 9 0 0.2520506E-16 1 0.1356435E-12 2 0.3255238E-13 3 0.5007550E-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 11 10 0 0.1122806E-34 1 0.2024273E-12 2 0.5559425E-13 3 0.1138960E-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 11 11 0 0.1012958E-14 1 0.8271502E-12 2 0.3109726E-12 3 0.9645807E-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 1 -1 0 0.2653616E-09 1 0.5260579E-04 2 0.3101431E-03 3 0.3656290E-03 4 0.3851541E-03 5 0.2278578E-03 6 0.7361593E-05 7 0.3525298E-08 8 0.1149038E-10 9 0.0000000E+00 v, j, mj = 1 1 0 0 0.1569666E-32 1 0.2082861E-04 2 0.2560766E-04 3 0.6617249E-04 4 0.5595114E-04 5 0.1232606E-04 6 0.2110257E-06 7 0.7296802E-10 8 0.2116305E-11 9 0.0000000E+00 v, j, mj = 1 1 1 0 0.7339734E-05 1 0.8592240E-04 2 0.1273368E-02 3 0.7879016E-03 4 0.3876689E-03 5 0.2825515E-03 6 0.5870405E-05 7 0.3424100E-08 8 0.4398472E-11 9 0.0000000E+00 v, j, mj = 1 3 -3 0 0.9255295E-10 1 0.1230303E-03 2 0.1908134E-03 3 0.1060945E-03 4 0.7405222E-04 5 0.8961703E-05 6 0.1909443E-07 7 0.6561942E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -2 0 0.2159546E-33 1 0.1323110E-04 2 0.4040925E-04 3 0.5693989E-04 4 0.8670162E-05 5 0.7753808E-06 6 0.2500912E-08 7 0.1067592E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 -1 0 0.2401069E-10 1 0.9488292E-04 2 0.2967168E-04 3 0.1345639E-05 4 0.9062439E-07 5 0.4577452E-06 6 0.5246230E-08 7 0.1953317E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 0 0 0.1084151E-32 1 0.3317932E-05 2 0.1216535E-04 3 0.6424963E-05 4 0.2636164E-05 5 0.1725045E-06 6 0.6524425E-09 7 0.1216619E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 1 0 0.7160509E-04 1 0.7596328E-04 2 0.4315990E-04 3 0.1549513E-04 4 0.5076489E-05 5 0.8388094E-06 6 0.7048684E-08 7 0.1511081E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 2 0 0.1940319E-32 1 0.2371031E-05 2 0.1754092E-04 3 0.4129130E-04 4 0.5122216E-05 5 0.6088532E-06 6 0.1982290E-08 7 0.2035281E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 3 3 0 0.1283439E-09 1 0.5344788E-04 2 0.2808023E-04 3 0.1458063E-03 4 0.1601118E-03 5 0.1193009E-04 6 0.4141662E-07 7 0.8389179E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -5 0 0.6457577E-05 1 0.1118140E-04 2 0.2524017E-03 3 0.4186259E-05 4 0.2403956E-07 5 0.1998796E-10 6 0.2723748E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -4 0 0.5669651E-34 1 0.1959049E-06 2 0.1629475E-05 3 0.2975353E-06 4 0.3419314E-08 5 0.3538817E-11 6 0.1908769E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -3 0 0.1082935E-11 1 0.1150908E-05 2 0.3387524E-06 3 0.5618994E-07 4 0.6701261E-09 5 0.2807319E-11 6 0.1007483E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -2 0 0.2924175E-34 1 0.7867803E-06 2 0.1126528E-06 3 0.1297884E-07 4 0.1462897E-09 5 0.1266736E-11 6 0.8185920E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -1 0 0.1316142E-12 1 0.1549248E-06 2 0.8043192E-07 3 0.1161766E-07 4 0.5193349E-09 5 0.2073472E-11 6 0.5270860E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 0 0 0.3213331E-35 1 0.1004010E-07 2 0.7595578E-07 3 0.6403793E-08 4 0.4435665E-09 5 0.9096452E-12 6 0.2091681E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 1 0 0.2601895E-06 1 0.2801828E-06 2 0.4423438E-06 3 0.3762002E-07 4 0.2223253E-08 5 0.4091424E-11 6 0.1103399E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 2 0 0.5666569E-34 1 0.7783967E-08 2 0.1496165E-06 3 0.1323993E-07 4 0.4843883E-09 5 0.1801736E-11 6 0.9274670E-12 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 3 0 0.4122379E-11 1 0.4166273E-06 2 0.4730772E-06 3 0.1300571E-06 4 0.3005985E-08 5 0.7629921E-11 6 0.1421337E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 4 0 0.8701743E-33 1 0.2647923E-04 2 0.2275614E-05 3 0.2482029E-06 4 0.5408027E-08 5 0.6557694E-11 6 0.1559005E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 5 0 0.2862298E-10 1 0.5970843E-04 2 0.4160555E-04 3 0.1827295E-04 4 0.6301773E-07 5 0.2628440E-10 6 0.3318922E-11 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -7 0 0.4333348E-13 1 0.2073293E-08 2 0.8312608E-09 3 0.8162653E-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 7 -6 0 0.1416875E-34 1 0.8884263E-11 2 0.7773173E-10 3 0.5388884E-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 7 -5 0 0.1062819E-10 1 0.4077391E-11 2 0.1057526E-10 3 0.1150831E-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 7 -4 0 0.8544978E-35 1 0.1832041E-12 2 0.2538918E-12 3 0.4451119E-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 7 -3 0 0.1198210E-14 1 0.5204630E-12 2 0.5937845E-12 3 0.5304672E-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 7 -2 0 0.3267350E-34 1 0.2099401E-12 2 0.1035088E-12 3 0.1785704E-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 7 -1 0 0.3128113E-15 1 0.2132905E-12 2 0.1237387E-12 3 0.1566136E-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 7 0 0 0.2495890E-34 1 0.9125544E-14 2 0.1651894E-13 3 0.8554297E-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 7 1 0 0.3269506E-12 1 0.5826322E-12 2 0.4796315E-12 3 0.2590746E-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 7 2 0 0.1074633E-34 1 0.2519049E-13 2 0.2202562E-13 3 0.1612657E-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 7 3 0 0.3823752E-15 1 0.3463189E-12 2 0.4738402E-12 3 0.5697444E-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 7 4 0 0.2897370E-34 1 0.1929717E-11 2 0.8154090E-12 3 0.4460692E-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 7 5 0 0.2370425E-15 1 0.3433052E-12 2 0.5132097E-12 3 0.1091539E-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 7 6 0 0.7127922E-34 1 0.3768233E-12 2 0.1031611E-10 3 0.6301128E-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 7 7 0 0.5144181E-09 1 0.4581479E-09 2 0.3794640E-09 3 0.2130265E-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 sum of the probabilities = 0.3154822 average vibrational energy (ev) = 0.010168 average rotational energy (ev) = 0.089628 average diffraction energy (ev) = 0.201004 the reaction probability = 0.6845178D+00 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ total energy = -0.33765001D+01 trans energy = 0.10857143D+01 trans energy in z = 0.10857143D+01 total momentum = 0.17122995D+02 $$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$$ ************************************ rotation-diffraction summed probabilities ************************************ v probability av edif av erot 0 0.1625964E+00 0.2202054E+00 0.1314151E+00 1 0.1179901E-01 0.1223397E+00 0.6307662E-01 2 0.6090776E-06 0.8264009E-02 0.1522552E-01 ************************************ diffraction summed probabilities ************************************ v irot j m probability 0 31 1 -1 0.1544491E-01 0 37 1 0 0.8616878E-02 0 43 1 1 0.1539805E-01 0 21 3 -3 0.9716962E-02 0 26 3 -2 0.7058347E-02 0 32 3 -1 0.1072551E-01 0 38 3 0 0.3906710E-02 0 44 3 1 0.1431031E-01 0 49 3 2 0.1170768E-01 0 54 3 3 0.1162990E-01 0 13 5 -5 0.3197869E-02 0 17 5 -4 0.3715971E-02 0 22 5 -3 0.5544356E-02 0 27 5 -2 0.3389034E-02 0 33 5 -1 0.1867797E-02 0 39 5 0 0.8311673E-03 0 45 5 1 0.1686074E-02 0 50 5 2 0.2874729E-02 0 55 5 3 0.6133510E-02 0 59 5 4 0.4987150E-02 0 63 5 5 0.4794528E-02 0 7 7 -7 0.1055080E-02 0 10 7 -6 0.1168926E-02 0 14 7 -5 0.1470140E-02 0 18 7 -4 0.7094645E-03 0 23 7 -3 0.4162447E-03 0 28 7 -2 0.4634342E-03 0 34 7 -1 0.1665151E-03 0 40 7 0 0.1886093E-03 0 46 7 1 0.5259405E-03 0 51 7 2 0.5409449E-03 0 56 7 3 0.7215687E-03 0 60 7 4 0.1237760E-02 0 64 7 5 0.2046190E-02 0 67 7 6 0.2052286E-02 0 70 7 7 0.1349001E-02 0 3 9 -9 0.1612590E-03 0 5 9 -8 0.6235778E-04 0 8 9 -7 0.1312499E-03 0 11 9 -6 0.3330086E-04 0 15 9 -5 0.6578772E-05 0 19 9 -4 0.6013186E-05 0 24 9 -3 0.2548849E-05 0 29 9 -2 0.1115333E-04 0 35 9 -1 0.3192818E-05 0 41 9 0 0.3812976E-05 0 47 9 1 0.1997264E-04 0 52 9 2 0.8817578E-05 0 57 9 3 0.5988275E-05 0 61 9 4 0.1652032E-04 0 65 9 5 0.7621533E-05 0 68 9 6 0.5070955E-04 0 71 9 7 0.1152908E-03 0 73 9 8 0.8432490E-04 0 75 9 9 0.2160559E-03 0 1 11 -11 0.6946101E-07 0 2 11 -10 0.9781058E-09 0 4 11 -9 0.3474466E-08 0 6 11 -8 0.1675399E-09 0 9 11 -7 0.5069141E-09 0 12 11 -6 0.3566695E-10 0 16 11 -5 0.5381199E-10 0 20 11 -4 0.1093848E-10 0 25 11 -3 0.4485036E-11 0 30 11 -2 0.5128963E-10 0 36 11 -1 0.1868712E-10 0 42 11 0 0.5265861E-10 0 48 11 1 0.1658348E-09 0 53 11 2 0.7161813E-10 0 58 11 3 0.4426716E-10 0 62 11 4 0.4718654E-10 0 66 11 5 0.1946489E-10 0 69 11 6 0.5374735E-10 0 72 11 7 0.1056544E-09 0 74 11 8 0.3276872E-10 0 76 11 9 0.5971306E-09 0 77 11 10 0.6616008E-09 0 78 11 11 0.2591718E-07 1 31 1 -1 0.2279793E-02 1 37 1 0 0.6812656E-03 1 43 1 1 0.3589403E-02 1 21 3 -3 0.9384072E-03 1 26 3 -2 0.3385435E-03 1 32 3 -1 0.3759862E-03 1 38 3 0 0.1695758E-03 1 44 3 1 0.5122773E-03 1 49 3 2 0.5412217E-03 1 54 3 3 0.1163169E-02 1 13 5 -5 0.2533806E-03 1 17 5 -4 0.1125139E-03 1 22 5 -3 0.5521944E-04 1 27 5 -2 0.3077730E-04 1 33 5 -1 0.6317627E-05 1 39 5 0 0.3880741E-05 1 45 5 1 0.6248244E-04 1 50 5 2 0.9466672E-05 1 55 5 3 0.9116321E-04 1 59 5 4 0.9928117E-04 1 63 5 5 0.3297077E-03 1 7 7 -7 0.9510142E-04 1 10 7 -6 0.1558615E-05 1 14 7 -5 0.5932030E-06 1 18 7 -4 0.4757583E-08 1 23 7 -3 0.4255107E-08 1 28 7 -2 0.1644261E-07 1 34 7 -1 0.3918529E-09 1 40 7 0 0.2248818E-09 1 46 7 1 0.2452370E-07 1 51 7 2 0.5479205E-09 1 56 7 3 0.1558808E-08 1 60 7 4 0.7521304E-07 1 64 7 5 0.7401915E-07 1 67 7 6 0.3159679E-06 1 70 7 7 0.5741030E-04 1 3 9 -9 0.0000000E+00 1 5 9 -8 0.0000000E+00 1 8 9 -7 0.0000000E+00 1 11 9 -6 0.0000000E+00 1 15 9 -5 0.0000000E+00 1 19 9 -4 0.0000000E+00 1 24 9 -3 0.0000000E+00 1 29 9 -2 0.0000000E+00 1 35 9 -1 0.0000000E+00 1 41 9 0 0.0000000E+00 1 47 9 1 0.0000000E+00 1 52 9 2 0.0000000E+00 1 57 9 3 0.0000000E+00 1 61 9 4 0.0000000E+00 1 65 9 5 0.0000000E+00 1 68 9 6 0.0000000E+00 1 71 9 7 0.0000000E+00 1 73 9 8 0.0000000E+00 1 75 9 9 0.0000000E+00 1 1 11 -11 0.0000000E+00 1 2 11 -10 0.0000000E+00 1 4 11 -9 0.0000000E+00 1 6 11 -8 0.0000000E+00 1 9 11 -7 0.0000000E+00 1 12 11 -6 0.0000000E+00 1 16 11 -5 0.0000000E+00 1 20 11 -4 0.0000000E+00 1 25 11 -3 0.0000000E+00 1 30 11 -2 0.0000000E+00 1 36 11 -1 0.0000000E+00 1 42 11 0 0.0000000E+00 1 48 11 1 0.0000000E+00 1 53 11 2 0.0000000E+00 1 58 11 3 0.0000000E+00 1 62 11 4 0.0000000E+00 1 66 11 5 0.0000000E+00 1 69 11 6 0.0000000E+00 1 72 11 7 0.0000000E+00 1 74 11 8 0.0000000E+00 1 76 11 9 0.0000000E+00 1 77 11 10 0.0000000E+00 1 78 11 11 0.0000000E+00 2 31 1 -1 0.2184934E-06 2 37 1 0 0.5230251E-09 2 43 1 1 0.3866551E-06 2 21 3 -3 0.2077335E-08 2 26 3 -2 0.1792939E-09 2 32 3 -1 0.1169913E-09 2 38 3 0 0.5826131E-12 2 44 3 1 0.1683079E-09 2 49 3 2 0.4034249E-10 2 54 3 3 0.8231601E-09 2 13 5 -5 0.0000000E+00 2 17 5 -4 0.0000000E+00 2 22 5 -3 0.0000000E+00 2 27 5 -2 0.0000000E+00 2 33 5 -1 0.0000000E+00 2 39 5 0 0.0000000E+00 2 45 5 1 0.0000000E+00 2 50 5 2 0.0000000E+00 2 55 5 3 0.0000000E+00 2 59 5 4 0.0000000E+00 2 63 5 5 0.0000000E+00 2 7 7 -7 0.0000000E+00 2 10 7 -6 0.0000000E+00 2 14 7 -5 0.0000000E+00 2 18 7 -4 0.0000000E+00 2 23 7 -3 0.0000000E+00 2 28 7 -2 0.0000000E+00 2 34 7 -1 0.0000000E+00 2 40 7 0 0.0000000E+00 2 46 7 1 0.0000000E+00 2 51 7 2 0.0000000E+00 2 56 7 3 0.0000000E+00 2 60 7 4 0.0000000E+00 2 64 7 5 0.0000000E+00 2 67 7 6 0.0000000E+00 2 70 7 7 0.0000000E+00 2 3 9 -9 0.0000000E+00 2 5 9 -8 0.0000000E+00 2 8 9 -7 0.0000000E+00 2 11 9 -6 0.0000000E+00 2 15 9 -5 0.0000000E+00 2 19 9 -4 0.0000000E+00 2 24 9 -3 0.0000000E+00 2 29 9 -2 0.0000000E+00 2 35 9 -1 0.0000000E+00 2 41 9 0 0.0000000E+00 2 47 9 1 0.0000000E+00 2 52 9 2 0.0000000E+00 2 57 9 3 0.0000000E+00 2 61 9 4 0.0000000E+00 2 65 9 5 0.0000000E+00 2 68 9 6 0.0000000E+00 2 71 9 7 0.0000000E+00 2 73 9 8 0.0000000E+00 2 75 9 9 0.0000000E+00 2 1 11 -11 0.0000000E+00 2 2 11 -10 0.0000000E+00 2 4 11 -9 0.0000000E+00 2 6 11 -8 0.0000000E+00 2 9 11 -7 0.0000000E+00 2 12 11 -6 0.0000000E+00 2 16 11 -5 0.0000000E+00 2 20 11 -4 0.0000000E+00 2 25 11 -3 0.0000000E+00 2 30 11 -2 0.0000000E+00 2 36 11 -1 0.0000000E+00 2 42 11 0 0.0000000E+00 2 48 11 1 0.0000000E+00 2 53 11 2 0.0000000E+00 2 58 11 3 0.0000000E+00 2 62 11 4 0.0000000E+00 2 66 11 5 0.0000000E+00 2 69 11 6 0.0000000E+00 2 72 11 7 0.0000000E+00 2 74 11 8 0.0000000E+00 2 76 11 9 0.0000000E+00 2 77 11 10 0.0000000E+00 2 78 11 11 0.0000000E+00 ************************************ probabilities as function of diffraction order ************************************ v, j, mj = 0 1 -1 0 0.7977411E-10 1 0.1699656E-03 2 0.2387825E-04 3 0.1398169E-03 4 0.1657587E-02 5 0.2679325E-02 6 0.2508380E-02 7 0.4799466E-02 8 0.3265141E-02 9 0.2013528E-03 v, j, mj = 0 1 0 0 0.3187869E-32 1 0.5650446E-04 2 0.2289103E-03 3 0.1139860E-03 4 0.8331344E-03 5 0.2034448E-02 6 0.2186848E-02 7 0.2347649E-02 8 0.7782228E-03 9 0.3717545E-04 v, j, mj = 0 1 1 0 0.2642740E-03 1 0.4486900E-03 2 0.8325870E-03 3 0.1249244E-02 4 0.2476971E-02 5 0.3030748E-02 6 0.2675536E-02 7 0.2458654E-02 8 0.1848670E-02 9 0.1126770E-03 v, j, mj = 0 3 -3 0 0.3866577E-10 1 0.1697543E-04 2 0.4522342E-03 3 0.5167583E-03 4 0.7298669E-03 5 0.1254470E-02 6 0.1013018E-02 7 0.4030612E-02 8 0.1630498E-02 9 0.7252851E-04 v, j, mj = 0 3 -2 0 0.1224061E-32 1 0.2554133E-04 2 0.1400812E-02 3 0.5607336E-03 4 0.4986175E-03 5 0.5384536E-03 6 0.2333540E-02 7 0.1449955E-02 8 0.2443021E-03 9 0.6391584E-05 v, j, mj = 0 3 -1 0 0.1388112E-10 1 0.9438348E-04 2 0.6132579E-03 3 0.5380715E-03 4 0.1124166E-02 5 0.1600375E-02 6 0.2255786E-02 7 0.3467194E-02 8 0.9917390E-03 9 0.4053308E-04 v, j, mj = 0 3 0 0 0.5481687E-33 1 0.1405315E-04 2 0.6667224E-04 3 0.1858150E-03 4 0.5373990E-03 5 0.7620303E-03 6 0.1050350E-02 7 0.1115447E-02 8 0.1710424E-03 9 0.3900901E-05 v, j, mj = 0 3 1 0 0.3562523E-04 1 0.1145720E-03 2 0.5758476E-03 3 0.1285950E-02 4 0.1105116E-02 5 0.2438589E-02 6 0.2902973E-02 7 0.4494989E-02 8 0.1314130E-02 9 0.4252204E-04 v, j, mj = 0 3 2 0 0.7059669E-33 1 0.1512602E-03 2 0.1476892E-03 3 0.1058036E-02 4 0.1381873E-02 5 0.1110436E-02 6 0.4323104E-02 7 0.2807562E-02 8 0.6986747E-03 9 0.2904480E-04 v, j, mj = 0 3 3 0 0.6758239E-10 1 0.8015092E-05 2 0.3554859E-03 3 0.8139159E-03 4 0.1152542E-02 5 0.1374444E-02 6 0.2028910E-02 7 0.4126207E-02 8 0.1688514E-02 9 0.8186361E-04 v, j, mj = 0 5 -5 0 0.1372756E-04 1 0.6332440E-04 2 0.5000479E-03 3 0.9924532E-04 4 0.4905314E-03 5 0.5089496E-03 6 0.9111294E-03 7 0.5456063E-03 8 0.6395094E-04 9 0.1356382E-05 v, j, mj = 0 5 -4 0 0.4197270E-34 1 0.1809423E-03 2 0.1587210E-03 3 0.5640095E-03 4 0.9839129E-03 5 0.8733022E-03 6 0.7198630E-03 7 0.1906524E-03 8 0.4368054E-04 9 0.8872217E-06 v, j, mj = 0 5 -3 0 0.7504352E-11 1 0.5478791E-04 2 0.6749072E-04 3 0.4739457E-03 4 0.1147014E-02 5 0.1881374E-02 6 0.1337857E-02 7 0.5201510E-03 8 0.6075000E-04 9 0.9853282E-06 v, j, mj = 0 5 -2 0 0.4617434E-33 1 0.5140016E-04 2 0.1311324E-03 3 0.1840321E-03 4 0.4173782E-03 5 0.5797736E-03 6 0.9527127E-03 7 0.9201179E-03 8 0.1495596E-03 9 0.2927613E-05 v, j, mj = 0 5 -1 0 0.1274431E-11 1 0.3581455E-04 2 0.1033949E-03 3 0.9353250E-04 4 0.9688562E-04 5 0.2622604E-03 6 0.6357818E-03 7 0.5640538E-03 8 0.7508035E-04 9 0.9929903E-06 v, j, mj = 0 5 0 0 0.1646212E-32 1 0.1086768E-04 2 0.4640823E-04 3 0.6474156E-04 4 0.1650116E-03 5 0.9224329E-04 6 0.2531657E-03 7 0.1820672E-03 8 0.1645140E-04 9 0.2106561E-06 v, j, mj = 0 5 1 0 0.2562878E-04 1 0.6859812E-04 2 0.3052619E-03 3 0.4341325E-03 4 0.3117723E-03 5 0.1777709E-03 6 0.1371106E-03 7 0.1668713E-03 8 0.5709432E-04 9 0.1833690E-05 v, j, mj = 0 5 2 0 0.6962964E-32 1 0.8048147E-05 2 0.6558945E-04 3 0.1898879E-03 4 0.3312277E-03 5 0.3399495E-03 6 0.1144086E-02 7 0.7423333E-03 8 0.5314790E-04 9 0.4588552E-06 v, j, mj = 0 5 3 0 0.5046093E-10 1 0.2082321E-03 2 0.4285105E-04 3 0.4425757E-03 4 0.7065601E-03 5 0.1510102E-02 6 0.2385968E-02 7 0.7987780E-03 8 0.3785961E-04 9 0.5831445E-06 v, j, mj = 0 5 4 0 0.9380155E-33 1 0.1639626E-03 2 0.1054794E-03 3 0.1918516E-03 4 0.8255687E-03 5 0.1888699E-02 6 0.1571018E-02 7 0.2254672E-03 8 0.1477217E-04 9 0.3323222E-06 v, j, mj = 0 5 5 0 0.2648213E-10 1 0.1135969E-03 2 0.3061663E-04 3 0.6724579E-03 4 0.5148867E-03 5 0.7783472E-03 6 0.9613522E-03 7 0.1471651E-02 8 0.2478466E-03 9 0.3773103E-05 v, j, mj = 0 7 -7 0 0.1136671E-10 1 0.1831290E-03 2 0.1819424E-03 3 0.3457294E-03 4 0.1511671E-03 5 0.1400171E-03 6 0.4970994E-04 7 0.3348051E-05 8 0.3619594E-07 9 0.8987634E-09 v, j, mj = 0 7 -6 0 0.4263730E-33 1 0.1284344E-03 2 0.1260062E-03 3 0.5126451E-03 4 0.1329099E-03 5 0.2430223E-03 6 0.2256818E-04 7 0.3235853E-05 8 0.1039669E-06 9 0.3745743E-09 v, j, mj = 0 7 -5 0 0.3255449E-04 1 0.1633553E-04 2 0.4761066E-03 3 0.1666203E-03 4 0.5616989E-03 5 0.1484015E-03 6 0.5737982E-04 7 0.1069698E-04 8 0.3458142E-06 9 0.3642135E-09 v, j, mj = 0 7 -4 0 0.1027833E-32 1 0.7481616E-06 2 0.1636567E-03 3 0.1245759E-03 4 0.1960515E-03 5 0.1258273E-03 6 0.7117188E-04 7 0.2654290E-04 8 0.8893547E-06 9 0.8779064E-09 v, j, mj = 0 7 -3 0 0.6469877E-11 1 0.9774360E-05 2 0.2704592E-05 3 0.8746490E-04 4 0.6310519E-04 5 0.6224381E-04 6 0.1394338E-03 7 0.5016212E-04 8 0.1354775E-05 9 0.1126566E-08 v, j, mj = 0 7 -2 0 0.4146323E-33 1 0.3534057E-04 2 0.4478953E-04 3 0.1075978E-03 4 0.3213294E-04 5 0.3699537E-04 6 0.1526335E-03 7 0.5265082E-04 8 0.1292380E-05 9 0.1204162E-08 v, j, mj = 0 7 -1 0 0.1262130E-11 1 0.1068913E-04 2 0.5988946E-05 3 0.9644634E-05 4 0.3330893E-04 5 0.1352466E-04 6 0.7118738E-04 7 0.2167653E-04 8 0.4943389E-06 9 0.5737914E-09 v, j, mj = 0 7 0 0 0.3006186E-33 1 0.1847832E-05 2 0.1134662E-04 3 0.3751268E-04 4 0.9974484E-05 5 0.6967166E-04 6 0.5206415E-04 7 0.6111579E-05 8 0.8027570E-07 9 0.5363717E-10 v, j, mj = 0 7 1 0 0.3267135E-04 1 0.1744181E-04 2 0.1970036E-03 3 0.1059927E-03 4 0.1030766E-03 5 0.5584671E-04 6 0.1183813E-04 7 0.2030417E-05 8 0.3915634E-07 9 0.4715776E-10 v, j, mj = 0 7 2 0 0.3410070E-33 1 0.4799108E-05 2 0.6577130E-04 3 0.6532780E-04 4 0.1239806E-03 5 0.2996884E-04 6 0.1997281E-03 7 0.5044536E-04 8 0.9229804E-06 9 0.7631848E-09 v, j, mj = 0 7 3 0 0.2270588E-10 1 0.1638965E-04 2 0.2484320E-04 3 0.7266796E-04 4 0.7088153E-04 5 0.1695507E-03 6 0.2935509E-03 7 0.7218580E-04 8 0.1497726E-05 9 0.1169284E-08 v, j, mj = 0 7 4 0 0.1784456E-34 1 0.9700256E-04 2 0.1761486E-04 3 0.2917561E-03 4 0.2345360E-03 5 0.2458691E-03 6 0.2802081E-03 7 0.6933383E-04 8 0.1438996E-05 9 0.9239251E-09 v, j, mj = 0 7 5 0 0.5454216E-11 1 0.5644850E-04 2 0.5923968E-04 3 0.7298986E-03 4 0.4179612E-03 5 0.5870572E-03 6 0.1649431E-03 7 0.2991499E-04 8 0.7265225E-06 9 0.4823353E-09 v, j, mj = 0 7 6 0 0.8129501E-34 1 0.7631297E-04 2 0.4756450E-03 3 0.4116878E-03 4 0.7007961E-03 5 0.2923830E-03 6 0.8798077E-04 7 0.7327911E-05 8 0.1518519E-06 9 0.3393313E-09 v, j, mj = 0 7 7 0 0.8007017E-04 1 0.4414085E-04 2 0.4418687E-03 3 0.1364014E-03 4 0.3107128E-03 5 0.2228788E-03 6 0.1014974E-03 7 0.1120177E-04 8 0.2284723E-06 9 0.4340963E-09 v, j, mj = 0 9 -9 0 0.4573393E-11 1 0.7221022E-04 2 0.4016795E-04 3 0.4057991E-04 4 0.7907404E-05 5 0.3889536E-06 6 0.4530708E-08 7 0.2736001E-11 8 0.1138800E-12 9 0.0000000E+00 v, j, mj = 0 9 -8 0 0.1596307E-33 1 0.2975513E-05 2 0.3433902E-04 3 0.1939979E-04 4 0.5438890E-05 5 0.2035198E-06 6 0.1054556E-08 7 0.1279664E-11 8 0.9347338E-13 9 0.0000000E+00 v, j, mj = 0 9 -7 0 0.1713986E-10 1 0.3615054E-04 2 0.4552455E-04 3 0.4491107E-04 4 0.4484207E-05 5 0.1746110E-06 6 0.4914821E-08 7 0.4825732E-11 8 0.9259932E-13 9 0.0000000E+00 v, j, mj = 0 9 -6 0 0.5401101E-33 1 0.2217711E-05 2 0.2599703E-04 3 0.3662509E-05 4 0.1275127E-05 5 0.1446146E-06 6 0.3848165E-08 7 0.1923160E-10 8 0.1137316E-12 9 0.0000000E+00 v, j, mj = 0 9 -5 0 0.4208912E-06 1 0.3848269E-06 2 0.4253564E-05 3 0.8256297E-06 4 0.5865352E-06 5 0.9398929E-07 6 0.1325154E-07 7 0.8315967E-10 8 0.1571229E-12 9 0.0000000E+00 v, j, mj = 0 9 -4 0 0.5257003E-34 1 0.4504314E-07 2 0.4179158E-05 3 0.9850363E-06 4 0.5384457E-06 5 0.2240954E-06 6 0.4118705E-07 7 0.2207231E-09 8 0.8815423E-13 9 0.0000000E+00 v, j, mj = 0 9 -3 0 0.7929111E-12 1 0.2094227E-06 2 0.4762916E-06 3 0.9537503E-06 4 0.3828933E-06 5 0.4605118E-06 6 0.6570083E-07 7 0.2773849E-09 8 0.9026132E-13 9 0.0000000E+00 v, j, mj = 0 9 -2 0 0.6211148E-34 1 0.5259984E-05 2 0.2147363E-05 3 0.2498549E-05 4 0.6786806E-06 5 0.5173201E-06 6 0.5125134E-07 7 0.1802423E-09 8 0.1896213E-12 9 0.0000000E+00 v, j, mj = 0 9 -1 0 0.2110925E-12 1 0.3797562E-06 2 0.3291673E-06 3 0.4771539E-06 4 0.1379503E-05 5 0.5988926E-06 6 0.2828835E-07 7 0.5600527E-10 8 0.9903892E-13 9 0.0000000E+00 v, j, mj = 0 9 0 0 0.1057393E-33 1 0.1784971E-07 2 0.1064403E-05 3 0.1293761E-05 4 0.1058315E-05 5 0.3615735E-06 6 0.1704012E-07 7 0.3261083E-10 8 0.7393093E-13 9 0.0000000E+00 v, j, mj = 0 9 1 0 0.7183557E-06 1 0.2164785E-05 2 0.1391471E-04 3 0.1650856E-05 4 0.1325194E-05 5 0.1889828E-06 6 0.9730467E-08 7 0.2529452E-10 8 0.3458707E-13 9 0.0000000E+00 v, j, mj = 0 9 2 0 0.1380076E-34 1 0.2072701E-06 2 0.3477307E-05 3 0.1610845E-05 4 0.2771414E-05 5 0.6899960E-06 6 0.6051781E-07 7 0.2276966E-09 8 0.1931362E-12 9 0.0000000E+00 v, j, mj = 0 9 3 0 0.1211698E-11 1 0.3796896E-06 2 0.9718541E-06 3 0.1083114E-05 4 0.1622515E-05 5 0.1750956E-05 6 0.1795559E-06 7 0.5883299E-09 8 0.2009261E-12 9 0.0000000E+00 v, j, mj = 0 9 4 0 0.2201456E-33 1 0.8626970E-05 2 0.2374185E-05 3 0.2644740E-05 4 0.8769621E-06 5 0.1774027E-05 6 0.2226391E-06 7 0.7918832E-09 8 0.9694785E-13 9 0.0000000E+00 v, j, mj = 0 9 5 0 0.1022885E-12 1 0.5237489E-06 2 0.3060994E-05 3 0.2266643E-05 4 0.7169901E-06 5 0.9240313E-06 6 0.1285697E-06 7 0.5559817E-09 8 0.2266161E-12 9 0.0000000E+00 v, j, mj = 0 9 6 0 0.9266143E-33 1 0.1529400E-05 2 0.3479267E-04 3 0.1054388E-04 4 0.3374099E-05 5 0.4316443E-06 6 0.3764564E-07 7 0.2004205E-09 8 0.2633516E-12 9 0.0000000E+00 v, j, mj = 0 9 7 0 0.1066955E-04 1 0.5075254E-05 2 0.7882431E-04 3 0.1430146E-04 4 0.5733105E-05 5 0.6744158E-06 6 0.1266391E-07 7 0.4420133E-10 8 0.2607681E-12 9 0.0000000E+00 v, j, mj = 0 9 8 0 0.3707446E-33 1 0.1475246E-04 2 0.2854492E-04 3 0.3426752E-04 4 0.6282342E-05 5 0.4684634E-06 6 0.9194765E-08 7 0.8322037E-11 8 0.1462980E-12 9 0.0000000E+00 v, j, mj = 0 9 9 0 0.7029782E-10 1 0.9137005E-04 2 0.6673715E-04 3 0.5115605E-04 4 0.5968702E-05 5 0.8034921E-06 6 0.2034215E-07 7 0.2453432E-11 8 0.2015758E-12 9 0.0000000E+00 v, j, mj = 0 11 -11 0 0.2824001E-07 1 0.2287118E-07 2 0.1804795E-07 3 0.3009951E-09 4 0.6772563E-12 5 0.1955230E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -10 0 0.9516131E-35 1 0.2015173E-09 2 0.7240934E-09 3 0.5162150E-10 4 0.8189398E-12 5 0.5462717E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -9 0 0.3273321E-14 1 0.2304554E-08 2 0.1122408E-08 3 0.4702400E-10 4 0.4310848E-12 5 0.4479724E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -8 0 0.4998049E-34 1 0.1102751E-09 2 0.3826422E-10 3 0.1882487E-10 4 0.1440192E-12 5 0.3169817E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -7 0 0.1959287E-14 1 0.3000266E-09 2 0.1998173E-09 3 0.6868405E-11 4 0.1521865E-12 5 0.4764308E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -6 0 0.2746870E-33 1 0.3212864E-12 2 0.3473503E-10 3 0.5100459E-12 4 0.7003790E-13 5 0.3055425E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -5 0 0.2176342E-10 1 0.1644824E-10 2 0.1478352E-10 3 0.7406942E-12 4 0.4486392E-13 5 0.3125185E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -4 0 0.2120456E-34 1 0.1180127E-11 2 0.9050117E-11 3 0.6242203E-12 4 0.5068213E-13 5 0.3333164E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -3 0 0.7243371E-16 1 0.3698979E-12 2 0.2926804E-11 3 0.1131025E-11 4 0.3931838E-13 5 0.1791864E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -2 0 0.7714931E-34 1 0.4657137E-10 2 0.3215094E-11 3 0.1392522E-11 4 0.9885620E-13 5 0.1179147E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 -1 0 0.1904375E-15 1 0.8261485E-11 2 0.8333752E-11 3 0.2010304E-11 4 0.4070333E-13 5 0.4068138E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 0 0 0.3104814E-34 1 0.3741592E-10 2 0.1297211E-10 3 0.2200092E-11 4 0.5908378E-13 5 0.1140784E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 1 0 0.3350586E-10 1 0.6637838E-10 2 0.6353085E-10 3 0.2352915E-11 4 0.4904302E-13 5 0.1778890E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 2 0 0.3228390E-34 1 0.4908207E-10 2 0.1807336E-10 3 0.4393739E-11 4 0.5706273E-13 5 0.1189381E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 3 0 0.1284813E-15 1 0.1800141E-10 2 0.2107866E-10 3 0.4859095E-11 4 0.2582678E-12 5 0.6959179E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 4 0 0.4983862E-34 1 0.3399740E-10 2 0.7923894E-11 3 0.5033679E-11 4 0.1747489E-12 5 0.5682071E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 5 0 0.1526687E-15 1 0.5000841E-11 2 0.9657602E-11 3 0.4665381E-11 4 0.9711267E-13 5 0.4379570E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 6 0 0.4856042E-34 1 0.9491439E-11 2 0.4003273E-10 3 0.4062556E-11 4 0.1095582E-12 5 0.5106474E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 7 0 0.2880063E-11 1 0.2693777E-11 2 0.9743924E-10 3 0.2276487E-11 4 0.2914941E-12 5 0.7331927E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 8 0 0.8963087E-34 1 0.2838878E-11 2 0.2576898E-10 3 0.3729747E-11 4 0.3378751E-12 5 0.9323861E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 9 0 0.5566050E-15 1 0.2776526E-09 2 0.2462175E-09 3 0.7272630E-10 4 0.5058400E-12 5 0.2777058E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 10 0 0.5552228E-34 1 0.2011750E-10 2 0.5642862E-09 3 0.7663052E-10 4 0.3587525E-12 5 0.2077604E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 0 11 11 0 0.1198016E-12 1 0.1795651E-07 2 0.7429213E-08 3 0.5290090E-09 4 0.2213158E-11 5 0.1096613E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 1 -1 0 0.4037789E-09 1 0.7277589E-04 2 0.5013718E-04 3 0.1625190E-03 4 0.4679945E-03 5 0.6634523E-03 6 0.8362995E-03 7 0.2660692E-04 8 0.7610264E-08 9 0.4630517E-11 v, j, mj = 1 1 0 0 0.1566715E-33 1 0.4481985E-04 2 0.5633006E-04 3 0.8496521E-04 4 0.8164605E-04 5 0.3610696E-03 6 0.5188000E-04 7 0.5547278E-06 8 0.1730176E-09 9 0.9352285E-12 v, j, mj = 1 1 1 0 0.4650847E-04 1 0.6293874E-04 2 0.6311182E-03 3 0.6235140E-03 4 0.9465446E-03 5 0.5875276E-03 6 0.6730353E-03 7 0.1820993E-04 8 0.6687604E-08 9 0.1218106E-10 v, j, mj = 1 3 -3 0 0.1013923E-09 1 0.2521946E-04 2 0.1174720E-03 3 0.1039031E-03 4 0.2423697E-03 5 0.3777295E-03 6 0.7149261E-04 7 0.2206799E-06 8 0.1146428E-10 9 0.0000000E+00 v, j, mj = 1 3 -2 0 0.7564340E-34 1 0.1950847E-04 2 0.3112116E-04 3 0.4206953E-04 4 0.1391751E-03 5 0.9802208E-04 6 0.8631141E-05 7 0.1606486E-07 8 0.1456526E-11 9 0.0000000E+00 v, j, mj = 1 3 -1 0 0.1252890E-10 1 0.1809238E-03 2 0.3650071E-04 3 0.6282078E-04 4 0.6770833E-04 5 0.2361694E-04 6 0.4363696E-05 7 0.5186358E-07 8 0.4054253E-11 9 0.0000000E+00 v, j, mj = 1 3 0 0 0.3881847E-32 1 0.3041833E-04 2 0.5860096E-04 3 0.1283886E-04 4 0.2605265E-04 5 0.3835433E-04 6 0.3303630E-05 7 0.7000478E-08 8 0.1241110E-11 9 0.0000000E+00 v, j, mj = 1 3 1 0 0.6633655E-04 1 0.7664715E-04 2 0.1982056E-03 3 0.2750360E-04 4 0.7629878E-04 5 0.6220629E-04 6 0.5041708E-05 7 0.3762812E-07 8 0.1655752E-11 9 0.0000000E+00 v, j, mj = 1 3 2 0 0.1107904E-32 1 0.3928169E-04 2 0.7702578E-04 3 0.1249351E-03 4 0.1266171E-03 5 0.1640344E-03 6 0.9321061E-05 7 0.6593951E-08 8 0.1710001E-11 9 0.0000000E+00 v, j, mj = 1 3 3 0 0.7517225E-10 1 0.9390608E-05 2 0.3174247E-04 3 0.1454443E-03 4 0.2486722E-03 5 0.5816484E-03 6 0.1457588E-03 7 0.5116288E-06 8 0.1569558E-10 9 0.0000000E+00 v, j, mj = 1 5 -5 0 0.4790167E-06 1 0.7398447E-05 2 0.9010288E-04 3 0.6591917E-04 4 0.8658673E-04 5 0.2890040E-05 6 0.4261775E-08 7 0.5485215E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -4 0 0.6177956E-33 1 0.2367800E-04 2 0.3752045E-04 3 0.3983401E-04 4 0.1123782E-04 5 0.2428363E-06 6 0.7365012E-09 7 0.9139250E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -3 0 0.4727701E-11 1 0.2185840E-04 2 0.1622420E-04 3 0.1595020E-04 4 0.9836795E-06 5 0.2028472E-06 6 0.1057245E-09 7 0.1046077E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -2 0 0.1163504E-32 1 0.1242961E-04 2 0.1038862E-04 3 0.7601069E-05 4 0.2969537E-06 5 0.6067969E-07 6 0.3643809E-09 7 0.3228162E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 -1 0 0.5966003E-11 1 0.1564231E-05 2 0.1437687E-05 3 0.2065134E-05 4 0.1220403E-05 5 0.2984707E-07 6 0.3180218E-09 7 0.4395088E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 0 0 0.2655565E-34 1 0.7727044E-06 2 0.1428482E-05 3 0.8213621E-06 4 0.7552087E-06 5 0.1027163E-06 6 0.2671456E-09 7 0.3079151E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 1 0 0.9879938E-05 1 0.1122132E-04 2 0.3829645E-04 3 0.2454263E-05 4 0.5682576E-06 5 0.6190670E-07 6 0.3087239E-09 7 0.3489625E-12 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 2 0 0.1588887E-32 1 0.1988925E-05 2 0.2716525E-05 3 0.4059073E-05 4 0.6100821E-06 5 0.9181315E-07 6 0.2529686E-09 7 0.1109093E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 3 0 0.2491231E-11 1 0.5564518E-04 2 0.1800332E-04 3 0.1101215E-04 4 0.6120095E-05 5 0.3807911E-06 6 0.1671833E-08 7 0.1379003E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 4 0 0.3172580E-33 1 0.1411220E-04 2 0.2058097E-04 3 0.4616372E-04 4 0.1784772E-04 5 0.5759651E-06 6 0.5837588E-09 7 0.2023259E-11 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 5 5 0 0.3694233E-10 1 0.3785011E-04 2 0.8036966E-04 3 0.1198331E-03 4 0.7923934E-04 5 0.1239876E-04 6 0.1675333E-07 7 0.1028014E-10 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -7 0 0.2974460E-10 1 0.7356738E-04 2 0.2026031E-04 3 0.1273182E-05 4 0.5091108E-09 5 0.6960676E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -6 0 0.4004154E-34 1 0.4129932E-06 2 0.1108257E-05 3 0.3730637E-07 4 0.5762494E-10 5 0.1052196E-11 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -5 0 0.2065349E-06 1 0.2429062E-06 2 0.1397184E-06 3 0.4038942E-08 4 0.4217433E-11 5 0.2443915E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -4 0 0.1488645E-33 1 0.5337355E-09 2 0.4150816E-08 3 0.7037647E-10 4 0.2449541E-11 5 0.2059764E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -3 0 0.8735296E-13 1 0.2575888E-08 2 0.1611829E-08 3 0.6704031E-10 4 0.1848278E-12 5 0.7738465E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -2 0 0.6359707E-34 1 0.1415183E-07 2 0.2039215E-08 3 0.2508030E-09 4 0.6925548E-12 5 0.6914487E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 -1 0 0.2005969E-13 1 0.2144732E-09 2 0.1448539E-09 3 0.3220936E-10 4 0.2137609E-12 5 0.8269102E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 0 0 0.6282927E-34 1 0.9536380E-10 2 0.1137558E-09 3 0.1516650E-10 4 0.5552887E-12 5 0.4034713E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 1 0 0.5019349E-08 1 0.7685176E-08 2 0.1173458E-07 3 0.8403048E-10 4 0.5129164E-12 5 0.5343431E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 2 0 0.4057105E-34 1 0.6036923E-10 2 0.3765308E-09 3 0.1099116E-09 4 0.1055913E-11 5 0.5291657E-13 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 3 0 0.1429343E-13 1 0.9872856E-09 2 0.5352205E-09 3 0.3463881E-10 4 0.1351944E-11 5 0.2969977E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 4 0 0.9707667E-34 1 0.6812755E-07 2 0.6668291E-08 3 0.4151276E-09 4 0.1464796E-11 5 0.6094158E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 5 0 0.2779551E-13 1 0.6217926E-07 2 0.1142233E-07 3 0.4135187E-09 4 0.3345487E-11 5 0.6685204E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 6 0 0.1213641E-33 1 0.5633604E-07 2 0.2208279E-06 3 0.3875889E-07 4 0.4403167E-10 5 0.9700638E-12 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 1 7 7 0 0.7704819E-06 1 0.2422152E-05 2 0.5392804E-04 3 0.2892958E-06 4 0.3120836E-09 5 0.1169600E-10 6 0.0000000E+00 7 0.0000000E+00 8 0.0000000E+00 9 0.0000000E+00 v, j, mj = 2 1 -1 0 0.5332826E-14 1 0.1661128E-06 2 0.5011659E-07 3 0.2263989E-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 = 2 1 0 0 0.9861953E-34 1 0.2350416E-09 2 0.2558771E-09 3 0.3210643E-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 = 2 1 1 0 0.2010023E-06 1 0.1544381E-06 2 0.3045739E-07 3 0.7574262E-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 = 2 3 -3 0 0.3969631E-13 1 0.2000930E-08 2 0.7636525E-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 = 2 3 -2 0 0.1607453E-32 1 0.1792406E-09 2 0.5329153E-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 = 2 3 -1 0 0.1002373E-12 1 0.1129394E-09 2 0.3951576E-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 = 2 3 0 0 0.7072484E-34 1 0.3980897E-12 2 0.1845233E-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 = 2 3 1 0 0.7007104E-10 1 0.9603448E-10 2 0.2202377E-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 = 2 3 2 0 0.6652026E-32 1 0.3569732E-10 2 0.4645168E-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 = 2 3 3 0 0.6359882E-15 1 0.7475740E-09 2 0.7558544E-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 sum of the probabilities = 0.1743960 average vibrational energy (ev) = 0.034765 average rotational energy (ev) = 0.126791 average diffraction energy (ev) = 0.213583 the reaction probability = 0.8256040D+00 etrans(icomin)= 0.400721 etrans(icomax)= 1.196820 etrans= 1.200000 CPU TIMES Total computation 403247.0634 (a) ... Propagating the wavefunction 402155.3273 (b) Setup time 164.1794 Saving the wave function for rerun 180.1103 Calculating averages 44.6319 Calculating and saving BK-coeffs 16.9396 Asymptotic analysis 15.6801 Saving the flux coefficients 0.0000 Flux analysis 0.0000 ----------------------------------------------------- Sum 402576.8686 (a) ... FFTs along X and Y 34794.4205 Kinetic energy operation along Z 90925.4860 Kinetic energy operation along r 85026.7496 Potential energy multiplication 59349.0277 Legengre transforms 106932.4979 Shifting the wavefunction 6783.1581 Kinetic energy multiplications (xy) 3685.8153 Absorbing the wavefunction 4488.7426 Projection formalism 35.6807 Operations on specular grid 0.2192 ----------------------------------------------------- Sum 392021.7976 (b) ... Potential initialisation time 0.0000 Potential setup time 110.8894 FFTs along X 18649.8933 FFTs along Y 16144.5272 Time spent on FGH for asympwf 0.5270 Ending date and time: Tue Nov 5 06:18:20 CET 2019