# LSTH 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 1.960913E-02 3.674894E-02 4.462433E-02 5.567937E-02 1.137477E-01 1.8 8.905147E-03 1.140686E-02 1.017435E-02 8.885404E-03 1.809090E-02 2.0 4.209641E-03 1.549343E-03 -2.950982E-03 -9.190477E-03 -2.219011E-02 2.2 1.858002E-03 -1.556962E-03 -6.396032E-03 -1.368118E-02 -3.549077E-02 2.4 5.349742E-04 -2.051530E-03 -6.012223E-03 -1.246048E-02 -3.565438E-02 2.6 -1.896651E-04 -1.707566E-03 -4.527279E-03 -9.478846E-03 -3.011986E-02 2.8 -4.859484E-04 -1.192200E-03 -3.037157E-03 -6.514563E-03 -2.296217E-02 3.0 -4.750114E-04 -7.201763E-04 -1.877361E-03 -4.189458E-03 -1.627119E-02 3.2 -2.803917E-04 -3.494940E-04 -1.078464E-03 -2.580505E-03 -1.093041E-02 3.4 -1.645274E-05 -9.264320E-05 -5.816435E-04 -1.566089E-03 -7.106966E-03 3.6 2.337431E-04 5.774436E-05 -3.112498E-04 -9.841493E-04 -4.589714E-03 3.8 4.242557E-04 1.242015E-04 -1.920913E-04 -6.865388E-04 -3.039468E-03 4.0 5.424534E-04 1.369146E-04 -1.585409E-04 -5.528682E-04 -2.130274E-03 4.2 5.957780E-04 1.272574E-04 -1.573548E-04 -4.943885E-04 -1.606047E-03 4.4 6.045792E-04 1.179576E-04 -1.547866E-04 -4.552277E-04 -1.290996E-03 4.6 5.874854E-04 1.194685E-04 -1.372683E-04 -4.097119E-04 -1.078464E-03 4.8 5.565204E-04 1.294817E-04 -1.062367E-04 -3.529340E-04 -9.136551E-04 5.0 5.160799E-04 1.402018E-04 -7.176131E-05 -2.927578E-04 -7.731536E-04 5.2 4.697317E-04 1.432410E-04 -4.369012E-05 -2.381116E-04 -6.514509E-04 5.4 4.189584E-04 1.364915E-04 -2.646597E-05 -1.953045E-04 -5.474049E-04 5.6 3.659982E-04 1.203875E-04 -1.970665E-05 -1.637464E-04 -4.608975E-04 5.8 3.125519E-04 9.932236E-05 -2.031835E-05 -1.414716E-04 -3.881274E-04 6.0 2.620124E-04 7.715508E-05 -2.339245E-05 -1.236001E-04 -3.258223E-04 6.2 2.163868E-04 5.872845E-05 -2.436952E-05 -1.070010E-04 -2.722544E-04 6.4 1.789036E-04 4.495794E-05 -2.370325E-05 -9.097102E-05 -2.249082E-04 6.6 1.470801E-04 3.587375E-05 -1.984038E-05 -7.435495E-05 -1.837886E-04 6.8 1.212391E-04 3.076833E-05 -1.457538E-05 -5.900855E-05 -1.484337E-04 7.0 1.012836E-04 2.689796E-05 -9.561171E-06 -4.546946E-05 -1.179659E-04 7.2 8.510235E-05 2.476746E-05 -4.650727E-06 -3.356583E-05 -9.253581E-05 7.4 7.122206E-05 2.448653E-05 3.919206E-07 -2.331906E-05 -7.214235E-05 7.6 6.165897E-05 2.308769E-05 3.891153E-06 -1.506536E-05 -5.537804E-05 7.8 5.300826E-05 2.205455E-05 6.303660E-06 -9.379600E-06 -4.171488E-05 8.0 4.430849E-05 2.053507E-05 8.120991E-06 -4.521653E-06 -3.134877E-05 8.2 3.802182E-05 1.860449E-05 8.693540E-06 -1.293516E-06 -2.289846E-05 8.4 3.316296E-05 1.747693E-05 9.191790E-06 8.176605E-07 -1.679150E-05 8.6 2.847717E-05 1.622397E-05 9.552631E-06 2.664154E-06 -1.224691E-05 8.8 2.420981E-05 1.445390E-05 9.155933E-06 3.671974E-06 -8.468426E-06 9.0 2.059682E-05 1.272627E-05 8.416998E-06 3.973901E-06 -5.739716E-06 9.2 1.761452E-05 1.129988E-05 7.794089E-06 4.164179E-06 -3.776883E-06 9.4 1.515762E-05 1.018507E-05 7.366329E-06 4.415082E-06 -2.145581E-06 9.6 1.312488E-05 9.275077E-06 7.017855E-06 4.624798E-06 -7.834722E-07 9.8 1.138338E-05 8.394963E-06 6.596916E-06 4.672732E-06 2.606012E-07 10.0 9.771790E-06 7.470287E-06 6.047963E-06 4.512904E-06 9.555399E-07 10.2 8.295686E-06 6.519462E-06 5.397811E-06 4.178771E-06 1.329878E-06 10.4 7.042478E-06 5.626150E-06 4.726820E-06 3.749103E-06 1.462189E-06 10.6 5.998948E-06 4.865025E-06 4.125087E-06 3.320792E-06 1.449828E-06 10.8 5.104645E-06 4.215512E-06 3.615342E-06 2.951577E-06 1.387172E-06 11.0 4.338594E-06 3.642825E-06 3.158991E-06 2.619275E-06 1.324284E-06 11.2 3.683140E-06 3.139695E-06 2.749687E-06 2.310821E-06 1.247176E-06 11.4 3.122994E-06 2.699316E-06 2.384939E-06 2.028030E-06 1.154320E-06 11.6 2.644902E-06 2.315213E-06 2.061773E-06 1.771448E-06 1.053619E-06 11.8 2.237375E-06 1.981301E-06 1.776943E-06 1.540701E-06 9.507720E-07 12.0 1.890452E-06 1.691922E-06 1.527086E-06 1.334771E-06 8.497669E-07 12.2 1.595509E-06 1.441870E-06 1.308852E-06 1.152211E-06 7.532804E-07 12.4 1.345083E-06 1.226392E-06 1.118988E-06 9.913211E-07 6.629998E-07 12.6 1.132729E-06 1.041186E-06 9.543995E-07 8.502689E-07 5.798779E-07 12.8 9.528838E-07 8.823845E-07 8.121960E-07 7.271876E-07 5.043333E-07 13.0 8.007587E-07 7.465341E-07 6.897091E-07 6.202412E-07 4.364049E-07 13.2 6.722350E-07 6.305676E-07 5.845047E-07 5.276713E-07 3.758715E-07 13.4 5.637777E-07 5.317759E-07 4.943830E-07 4.478261E-07 3.223413E-07 13.6 4.723575E-07 4.477771E-07 4.173722E-07 3.791783E-07 2.753196E-07 13.8 3.953827E-07 3.764865E-07 3.517170E-07 3.203334E-07 2.342573E-07 14.0 3.306400E-07 3.160864E-07 2.958648E-07 2.700312E-07 1.985868E-07 14.2 2.762420E-07 2.649977E-07 2.484495E-07 2.271425E-07 1.677462E-07 14.4 2.305818E-07 2.218533E-07 2.082751E-07 1.906637E-07 1.411962E-07 14.6 1.922933E-07 1.854731E-07 1.742990E-07 1.597079E-07 1.184304E-07 14.8 1.602170E-07 1.548413E-07 1.456159E-07 1.334963E-07 9.898135E-08 15.0 1.333698E-07 1.290860E-07 1.214426E-07 1.113482E-07 8.242341E-08 15.2 1.109198E-07 1.074604E-07 1.011037E-07 9.267117E-08 6.837323E-08 15.4 9.216328E-08 8.932658E-08 8.401843E-08 7.695192E-08 5.648872E-08 15.6 7.650633E-08 7.414054E-08 6.968877E-08 6.374719E-08 4.646695E-08 15.8 6.344794E-08 6.143942E-08 5.768886E-08 5.267549E-08 3.804148E-08 16.0 5.256605E-08 5.083009E-08 4.765528E-08 4.340948E-08 3.097933E-08 16.2 4.350553E-08 4.197925E-08 3.927862E-08 3.566905E-08 2.507780E-08 16.4 3.596784E-08 3.460479E-08 3.229599E-08 2.921512E-08 2.016136E-08 16.6 2.970228E-08 2.846829E-08 2.648443E-08 2.384411E-08 1.607863E-08 17.0 2.018039E-08 1.913609E-08 1.764887E-08 1.568536E-08 9.912798E-09 17.5 1.234910E-08 1.146805E-08 1.040140E-08 9.013095E-09 4.947779E-09 18.0 7.474337E-09 6.716011E-09 5.928750E-09 4.921739E-09 1.993569E-09 18.5 4.458918E-09 3.802725E-09 3.206830E-09 2.458672E-09 3.027910E-10 19.0 2.607127E-09 2.040300E-09 1.579517E-09 1.011511E-09 -6.088967E-10 19.5 1.479873E-09 9.924085E-10 6.297860E-10 1.902934E-10 -1.050841E-09 20.0 8.012777E-10 3.841104E-10 9.465026E-11 -2.509768E-10 -1.217725E-09