# BKMP1 lambda=2: V_2(H3) [5 H2-molecule sizes]: r, R in bohrs, V in hartrees. # # # R V2(r= .90000) V2(r=1.28000) V2(r=1.44900) V2(r=1.61800) V2(r=2.00000) #==== ------------- ------------- ============= ------------- ------------- 1.6 2.251363E-02 3.503893E-02 4.258032E-02 5.396795E-02 1.122121E-01 1.8 1.052127E-02 1.046361E-02 8.708288E-03 7.559933E-03 1.708748E-02 2.0 5.215233E-03 8.531243E-04 -4.167652E-03 -1.035184E-02 -2.307923E-02 2.2 2.595763E-03 -2.098711E-03 -7.454590E-03 -1.479888E-02 -3.645815E-02 2.4 1.214708E-03 -2.423713E-03 -6.892709E-03 -1.349452E-02 -3.669985E-02 2.6 5.851291E-04 -1.898493E-03 -5.215552E-03 -1.038000E-02 -3.114658E-02 2.8 3.779233E-04 -1.214426E-03 -3.538871E-03 -7.256033E-03 -2.388289E-02 3.0 3.203702E-04 -6.131256E-04 -2.214273E-03 -4.763064E-03 -1.702484E-02 3.2 2.546132E-04 -1.724729E-04 -1.290595E-03 -2.998364E-03 -1.147935E-02 3.4 1.355933E-04 9.249963E-05 -7.168207E-04 -1.856923E-03 -7.444227E-03 3.6 -1.560050E-05 2.020347E-04 -4.121265E-04 -1.182724E-03 -4.733787E-03 3.8 -1.574378E-04 2.006579E-04 -2.874506E-04 -8.224974E-04 -3.023705E-03 4.0 -2.554185E-04 1.436928E-04 -2.578105E-04 -6.442602E-04 -1.992145E-03 4.2 -2.928656E-04 8.119947E-05 -2.548489E-04 -5.472261E-04 -1.379132E-03 4.4 -2.714286E-04 4.529968E-05 -2.363849E-04 -4.675494E-04 -1.001064E-03 4.6 -2.062861E-04 4.559875E-05 -1.883890E-04 -3.772960E-04 -7.445816E-04 4.8 -1.191318E-04 7.324259E-05 -1.185977E-04 -2.758076E-04 -5.508827E-04 5.0 -3.123853E-05 1.103077E-04 -4.514924E-05 -1.765436E-04 -3.964349E-04 5.2 4.157730E-05 1.396413E-04 1.460171E-05 -9.448580E-05 -2.750623E-04 5.4 9.115764E-05 1.512563E-04 5.104699E-05 -3.818062E-05 -1.851914E-04 5.6 1.165495E-04 1.438753E-04 6.379761E-05 -7.658046E-06 -1.235632E-04 5.8 1.218504E-04 1.226350E-04 5.901845E-05 3.246417E-06 -8.418169E-05 6.0 1.135094E-04 9.519846E-05 4.520768E-05 2.885148E-06 -5.995564E-05 6.2 9.800655E-05 6.837391E-05 2.968929E-05 -1.548134E-06 -4.468676E-05 6.4 8.040539E-05 4.633645E-05 1.690366E-05 -5.613398E-06 -3.414516E-05 6.6 6.384906E-05 3.046820E-05 8.397059E-06 -7.588274E-06 -2.607572E-05 6.8 4.976261E-05 2.018246E-05 3.766823E-06 -7.548665E-06 -1.958803E-05 7.0 3.840109E-05 1.399517E-05 1.777419E-06 -6.325771E-06 -1.445337E-05 7.2 2.942566E-05 1.035461E-05 1.170332E-06 -4.777178E-06 -1.061283E-05 7.4 2.232555E-05 8.069308E-06 1.046147E-06 -3.462833E-06 -7.954367E-06 7.6 1.664275E-05 6.402969E-06 9.205464E-07 -2.613184E-06 -6.277100E-06 7.8 1.204364E-05 4.987732E-06 6.195684E-07 -2.230331E-06 -5.336237E-06 8.0 8.307302E-06 3.686298E-06 1.428186E-07 -2.206804E-06 -4.896171E-06 8.2 5.287168E-06 2.475443E-06 -4.416814E-07 -2.410022E-06 -4.762645E-06 8.4 2.876554E-06 1.372595E-06 -1.057334E-06 -2.725270E-06 -4.792347E-06 8.6 9.875136E-07 3.995984E-07 -1.643849E-06 -3.069260E-06 -4.888431E-06 8.8 -4.586232E-07 -4.303171E-07 -2.162392E-06 -3.388597E-06 -4.990465E-06 9.0 -1.533893E-06 -1.114329E-06 -2.592447E-06 -3.652995E-06 -5.063926E-06 9.2 -2.303568E-06 -1.657790E-06 -2.926671E-06 -3.848168E-06 -5.091466E-06 9.4 -2.825485E-06 -2.071300E-06 -3.166224E-06 -3.970083E-06 -5.066389E-06 9.6 -3.149696E-06 -2.368219E-06 -3.317241E-06 -4.020802E-06 -4.988192E-06 9.8 -3.318562E-06 -2.562865E-06 -3.388387E-06 -4.005722E-06 -4.859829E-06 10.0 -3.367285E-06 -2.669449E-06 -3.389445E-06 -3.932025E-06 -4.686351E-06 10.2 -3.324830E-06 -2.701740E-06 -3.330780E-06 -3.808089E-06 -4.474463E-06 10.4 -3.215122E-06 -2.673236E-06 -3.223356E-06 -3.643409E-06 -4.232193E-06 10.6 -3.058179E-06 -2.597326E-06 -3.078648E-06 -3.448211E-06 -3.966902E-06 10.8 -2.870742E-06 -2.486549E-06 -2.907153E-06 -3.230798E-06 -3.678566E-06 11.0 -2.665801E-06 -2.348854E-06 -2.712550E-06 -2.989843E-06 -3.361239E-06 11.2 -2.449083E-06 -2.179708E-06 -2.486641E-06 -2.719686E-06 -3.041029E-06 11.4 -2.213691E-06 -1.979823E-06 -2.246464E-06 -2.454950E-06 -2.750202E-06 11.6 -1.971992E-06 -1.801028E-06 -2.041282E-06 -2.228764E-06 -2.491325E-06 11.8 -1.790063E-06 -1.666714E-06 -1.874897E-06 -2.036650E-06 -2.260919E-06 12.0 -1.652037E-06 -1.553877E-06 -1.730450E-06 -1.867048E-06 -2.053940E-06 12.2 -1.488431E-06 -1.432022E-06 -1.586895E-06 -1.705311E-06 -1.863515E-06 12.4 -1.299233E-06 -1.280346E-06 -1.424451E-06 -1.534955E-06 -1.680503E-06 12.6 -1.140026E-06 -1.121669E-06 -1.248117E-06 -1.350407E-06 -1.494888E-06 12.8 -1.004263E-06 -9.923193E-07 -1.095366E-06 -1.178232E-06 -1.306059E-06 13.0 -8.818988E-07 -8.799757E-07 -9.684818E-07 -1.037844E-06 -1.136700E-06 13.2 -7.720632E-07 -7.776581E-07 -8.542485E-07 -9.143759E-07 -9.979979E-07 13.4 -6.739922E-07 -6.849720E-07 -7.511909E-07 -8.032972E-07 -8.760828E-07 13.6 -5.868377E-07 -6.015008E-07 -6.587033E-07 -7.038231E-07 -7.671740E-07 13.8 -5.097128E-07 -5.267206E-07 -5.760948E-07 -6.151376E-07 -6.702647E-07 14.0 -4.417255E-07 -4.600408E-07 -5.026266E-07 -5.363899E-07 -5.843555E-07 14.2 -3.820028E-07 -4.008363E-07 -4.375422E-07 -4.667245E-07 -5.084584E-07 14.4 -3.297082E-07 -3.484721E-07 -3.800906E-07 -4.053018E-07 -4.416166E-07 14.6 -2.840523E-07 -3.023209E-07 -3.295424E-07 -3.513147E-07 -3.829194E-07 14.8 -2.443007E-07 -2.617771E-07 -2.852018E-07 -3.039987E-07 -3.315112E-07 15.0 -2.097765E-07 -2.262650E-07 -2.464142E-07 -2.626389E-07 -2.865972E-07 15.2 -1.798620E-07 -1.952454E-07 -2.125714E-07 -2.265739E-07 -2.474458E-07 15.4 -1.539979E-07 -1.682186E-07 -1.831129E-07 -1.951971E-07 -2.133892E-07 15.6 -1.316808E-07 -1.447257E-07 -1.575273E-07 -1.679563E-07 -1.838219E-07 15.8 -1.124604E-07 -1.243492E-07 -1.353508E-07 -1.443524E-07 -1.581982E-07 16.0 -9.593609E-08 -1.067112E-07 -1.161657E-07 -1.239370E-07 -1.360290E-07 16.2 -8.175300E-08 -9.147244E-08 -9.959788E-08 -1.063090E-07 -1.168780E-07 16.4 -6.959815E-08 -7.832951E-08 -8.531372E-08 -9.111160E-08 -1.003578E-07 16.6 -5.919649E-08 -6.701257E-08 -7.301726E-08 -7.802869E-08 -8.612551E-08 17.0 -4.271989E-08 -4.892893E-08 -5.337232E-08 -5.712352E-08 -6.335280E-08 17.5 -2.830560E-08 -3.290534E-08 -3.596447E-08 -3.858838E-08 -4.310801E-08 18.0 -1.869406E-08 -2.207116E-08 -2.418797E-08 -2.603581E-08 -2.934405E-08 18.5 -1.232051E-08 -1.478805E-08 -1.626298E-08 -1.757539E-08 -2.002100E-08 19.0 -8.113292E-09 -9.914080E-09 -1.095087E-08 -1.189257E-08 -1.372011E-08 19.5 -5.345980E-09 -6.662815E-09 -7.399505E-09 -8.083213E-09 -9.464667E-09 20.0 -3.530450E-09 -4.498125E-09 -5.028197E-09 -5.531161E-09 -6.587908E-09