# BKMP1 lambda=0: V_0(H3) [5 H2-molecule sizes]: r, R in bohrs, V in hartrees. # # # R V0(r= .90000) V0(r=1.28000) V0(r=1.44900) V0(r=1.61800) V0(r=2.00000) #==== ------------- ------------- ============= ------------- ------------- 1.6 1.157730E-01 1.043850E-01 9.626594E-02 8.649254E-02 5.929467E-02 1.8 8.517230E-02 7.466901E-02 6.704894E-02 5.761482E-02 3.161352E-02 2.0 6.358082E-02 5.527053E-02 4.889441E-02 4.068640E-02 1.690327E-02 2.2 4.782492E-02 4.182527E-02 3.691309E-02 3.031331E-02 9.886098E-03 2.4 3.598154E-02 3.198373E-02 2.844458E-02 2.347723E-02 6.960960E-03 2.6 2.690486E-02 2.451066E-02 2.209941E-02 1.856361E-02 5.945709E-03 2.8 1.991993E-02 1.873552E-02 1.717369E-02 1.477126E-02 5.622692E-03 3.0 1.457579E-02 1.425011E-02 1.329142E-02 1.172329E-02 5.398422E-03 3.2 1.052606E-02 1.076668E-02 1.021854E-02 9.234374E-03 5.045004E-03 3.4 7.494039E-03 8.063208E-03 7.784739E-03 7.195131E-03 4.525654E-03 3.6 5.259181E-03 5.966099E-03 5.858252E-03 5.527725E-03 3.890061E-03 3.8 3.643682E-03 4.343394E-03 4.338546E-03 4.173174E-03 3.210185E-03 4.0 2.500893E-03 3.097433E-03 3.150775E-03 3.086758E-03 2.549869E-03 4.2 1.708782E-03 2.155264E-03 2.238075E-03 2.232930E-03 1.954628E-03 4.4 1.167849E-03 1.459042E-03 1.553498E-03 1.579621E-03 1.450144E-03 4.6 8.006126E-04 9.590556E-04 1.054349E-03 1.094352E-03 1.044283E-03 4.8 5.502153E-04 6.105480E-04 7.001983E-04 7.435785E-04 7.312182E-04 5.0 3.772899E-04 3.737183E-04 4.539256E-04 4.947304E-04 4.968690E-04 5.2 2.557708E-04 2.151856E-04 2.839516E-04 3.192066E-04 3.243498E-04 5.4 1.688064E-04 1.092176E-04 1.659047E-04 1.945519E-04 1.980570E-04 5.6 1.055643E-04 3.776134E-05 8.279873E-05 1.049568E-04 1.057207E-04 5.8 5.907485E-05 -1.076331E-05 2.381599E-05 4.024290E-05 3.863751E-05 6.0 2.484973E-05 -4.333872E-05 -1.760167E-05 -5.895453E-06 -9.140419E-06 6.2 -3.933772E-08 -6.419852E-05 -4.557953E-05 -3.758199E-05 -4.185134E-05 6.4 -1.760342E-05 -7.618878E-05 -6.308696E-05 -5.791484E-05 -6.280652E-05 6.6 -2.935983E-05 -8.152384E-05 -7.258370E-05 -6.952132E-05 -7.478517E-05 6.8 -3.656430E-05 -8.207247E-05 -7.621228E-05 -7.469786E-05 -8.014923E-05 7.0 -4.030038E-05 -7.939712E-05 -7.578122E-05 -7.537510E-05 -8.084305E-05 7.2 -4.149217E-05 -7.472820E-05 -7.271925E-05 -7.307501E-05 -7.839212E-05 7.4 -4.089679E-05 -6.896541E-05 -6.807902E-05 -6.892423E-05 -7.394003E-05 7.6 -3.910665E-05 -6.272253E-05 -6.259228E-05 -6.371702E-05 -6.831528E-05 7.8 -3.656749E-05 -5.639580E-05 -5.674812E-05 -5.799679E-05 -6.210502E-05 8.0 -3.360539E-05 -5.023154E-05 -5.086677E-05 -5.213022E-05 -5.571910E-05 8.2 -3.045429E-05 -4.437889E-05 -4.515599E-05 -4.636305E-05 -4.943873E-05 8.4 -2.727923E-05 -3.892516E-05 -3.974853E-05 -4.085733E-05 -4.345109E-05 8.6 -2.419385E-05 -3.391739E-05 -3.472558E-05 -3.571560E-05 -3.787380E-05 8.8 -2.127335E-05 -2.937512E-05 -3.013150E-05 -3.099682E-05 -3.277286E-05 9.0 -1.856412E-05 -2.529854E-05 -2.598380E-05 -2.672791E-05 -2.817650E-05 9.2 -1.609116E-05 -2.167416E-05 -2.228063E-05 -2.291253E-05 -2.408595E-05 9.4 -1.386404E-05 -1.847916E-05 -1.900665E-05 -1.953808E-05 -2.048394E-05 9.6 -1.188149E-05 -1.568481E-05 -1.613754E-05 -1.658120E-05 -1.734128E-05 9.8 -1.013496E-05 -1.325904E-05 -1.364356E-05 -1.401185E-05 -1.462178E-05 10.0 -8.611143E-06 -1.116829E-05 -1.149211E-05 -1.179647E-05 -1.228585E-05 10.2 -7.293706E-06 -9.378822E-06 -9.649518E-06 -9.900117E-06 -1.029317E-05 10.4 -6.164501E-06 -7.857644E-06 -8.082456E-06 -8.288144E-06 -8.604456E-06 10.6 -5.204497E-06 -6.573254E-06 -6.758892E-06 -6.927280E-06 -7.182230E-06 10.8 -4.394694E-06 -5.496119E-06 -5.648552E-06 -5.785827E-06 -5.989598E-06 11.0 -3.716836E-06 -4.598194E-06 -4.721767E-06 -4.831699E-06 -4.989277E-06 11.2 -3.152712E-06 -3.849822E-06 -3.946437E-06 -4.031419E-06 -4.152263E-06 11.4 -2.679689E-06 -3.220065E-06 -3.294423E-06 -3.361037E-06 -3.457176E-06 11.6 -2.271938E-06 -2.691078E-06 -2.750553E-06 -2.804223E-06 -2.881952E-06 11.8 -1.920436E-06 -2.250688E-06 -2.299085E-06 -2.342831E-06 -2.406706E-06 12.0 -1.621063E-06 -1.883733E-06 -1.924020E-06 -1.960424E-06 -2.014296E-06 12.2 -1.367026E-06 -1.576812E-06 -1.611479E-06 -1.642800E-06 -1.690037E-06 12.4 -1.159572E-06 -1.320633E-06 -1.350453E-06 -1.378067E-06 -1.421382E-06 12.6 -9.965471E-07 -1.112682E-06 -1.135467E-06 -1.158270E-06 -1.197936E-06 12.8 -8.632960E-07 -9.479439E-07 -9.642350E-07 -9.807921E-07 -1.012766E-06 13.0 -7.522121E-07 -8.137873E-07 -8.265318E-07 -8.394427E-07 -8.632793E-07 13.2 -6.593928E-07 -7.031911E-07 -7.132809E-07 -7.238393E-07 -7.437694E-07 13.4 -5.816277E-07 -6.118359E-07 -6.198227E-07 -6.284934E-07 -6.457191E-07 13.6 -5.162474E-07 -5.361764E-07 -5.425015E-07 -5.496501E-07 -5.646106E-07 13.8 -4.610432E-07 -4.732950E-07 -4.783101E-07 -4.842291E-07 -4.972744E-07 14.0 -4.141951E-07 -4.208007E-07 -4.247851E-07 -4.297088E-07 -4.411232E-07 14.2 -3.742089E-07 -3.767417E-07 -3.799167E-07 -3.840324E-07 -3.940489E-07 14.4 -3.398624E-07 -3.395312E-07 -3.420713E-07 -3.455291E-07 -3.543400E-07 14.6 -3.101583E-07 -3.078830E-07 -3.099255E-07 -3.128455E-07 -3.206113E-07 14.8 -2.842854E-07 -2.807580E-07 -2.824106E-07 -2.848893E-07 -2.917449E-07 15.0 -2.615850E-07 -2.573190E-07 -2.586660E-07 -2.607809E-07 -2.668407E-07 15.2 -2.415228E-07 -2.368932E-07 -2.380004E-07 -2.398139E-07 -2.451758E-07 15.4 -2.236664E-07 -2.189411E-07 -2.198598E-07 -2.214224E-07 -2.261705E-07 15.6 -2.076655E-07 -2.030306E-07 -2.038004E-07 -2.051531E-07 -2.093604E-07 15.8 -1.932363E-07 -1.888160E-07 -1.894679E-07 -1.906440E-07 -1.943739E-07 16.0 -1.801488E-07 -1.760208E-07 -1.765787E-07 -1.776054E-07 -1.809136E-07 16.2 -1.682160E-07 -1.644239E-07 -1.649064E-07 -1.658061E-07 -1.687413E-07 16.4 -1.572855E-07 -1.538481E-07 -1.542695E-07 -1.550607E-07 -1.576659E-07 16.6 -1.472326E-07 -1.441511E-07 -1.445225E-07 -1.452206E-07 -1.475336E-07 17.0 -1.293658E-07 -1.269562E-07 -1.272519E-07 -1.277999E-07 -1.296254E-07 17.5 -1.104720E-07 -1.087723E-07 -1.090026E-07 -1.094132E-07 -1.107746E-07 18.0 -9.462789E-08 -9.347415E-08 -9.365822E-08 -9.396971E-08 -9.498893E-08 18.5 -8.124939E-08 -8.049363E-08 -8.064298E-08 -8.088178E-08 -8.164871E-08 19.0 -6.990770E-08 -6.943083E-08 -6.955299E-08 -6.973776E-08 -7.031852E-08 19.5 -6.027028E-08 -5.998266E-08 -6.008299E-08 -6.022716E-08 -6.067028E-08 20.0 -5.206865E-08 -5.190579E-08 -5.198837E-08 -5.210178E-08 -5.244281E-08