# BKMP1 lambda=4: V_4(H3) [5 H2-molecule sizes]: r, R in bohrs, V in hartrees. # # # R V4(r= .90000) V4(r=1.28000) V4(r=1.44900) V4(r=1.61800) V4(r=2.00000) #==== ------------- ------------- ============= ------------- ------------- 1.6 4.183194E-03 2.389359E-02 4.128933E-02 6.600416E-02 1.473419E-01 1.8 1.861063E-03 1.108766E-02 1.977092E-02 3.262036E-02 8.041348E-02 2.0 8.731562E-04 4.996150E-03 9.146578E-03 1.550805E-02 4.277993E-02 2.2 5.709465E-04 2.133917E-03 3.897293E-03 6.609421E-03 2.101929E-02 2.4 5.694298E-04 8.507828E-04 1.485331E-03 2.282994E-03 8.440025E-03 2.6 6.004923E-04 2.945890E-04 4.895231E-04 4.677347E-04 1.729589E-03 2.8 5.803442E-04 4.601859E-05 1.237547E-04 -1.182532E-04 -1.240953E-03 3.0 5.397191E-04 -8.456722E-05 -3.672200E-06 -2.093308E-04 -2.042335E-03 3.2 5.193964E-04 -1.741309E-04 -6.246032E-05 -1.624074E-04 -1.809339E-03 3.4 5.232463E-04 -2.462573E-04 -1.113290E-04 -1.160421E-04 -1.271990E-03 3.6 5.258672E-04 -2.998673E-04 -1.585434E-04 -1.023451E-04 -7.829958E-04 3.8 4.997296E-04 -3.252732E-04 -1.932339E-04 -1.105191E-04 -4.469325E-04 4.0 4.349710E-04 -3.147583E-04 -2.026509E-04 -1.194556E-04 -2.509375E-04 4.2 3.421176E-04 -2.687014E-04 -1.814434E-04 -1.135609E-04 -1.473454E-04 4.4 2.419442E-04 -1.967951E-04 -1.345155E-04 -8.853750E-05 -9.232134E-05 4.6 1.527357E-04 -1.149488E-04 -7.462437E-05 -5.032569E-05 -5.810316E-05 4.8 8.310288E-05 -3.989822E-05 -1.698646E-05 -1.008635E-05 -3.228311E-05 5.0 3.230603E-05 1.590553E-05 2.624298E-05 2.162245E-05 -1.209074E-05 5.2 -5.013095E-06 4.715319E-05 4.932904E-05 3.888675E-05 1.655888E-06 5.4 -3.401202E-05 5.561841E-05 5.328786E-05 4.153332E-05 8.515434E-06 5.6 -5.726817E-05 4.784212E-05 4.379246E-05 3.368206E-05 9.765199E-06 5.8 -7.493132E-05 3.195136E-05 2.809826E-05 2.111458E-05 7.880195E-06 6.0 -8.613476E-05 1.496419E-05 1.241460E-05 8.889240E-06 5.363890E-06 6.2 -9.035491E-05 1.342923E-06 5.229658E-07 4.444297E-08 3.868495E-06 6.4 -8.806131E-05 -7.157931E-06 -6.319011E-06 -4.521843E-06 3.955089E-06 6.6 -8.065169E-05 -1.079272E-05 -8.655025E-06 -5.418751E-06 5.360906E-06 6.8 -6.999687E-05 -1.085031E-05 -7.876392E-06 -3.922183E-06 7.451948E-06 7.0 -5.793965E-05 -8.835216E-06 -5.457386E-06 -1.314599E-06 9.598622E-06 7.2 -4.595349E-05 -5.987000E-06 -2.538992E-06 1.456245E-06 1.136876E-05 7.4 -3.501162E-05 -3.117667E-06 1.806342E-07 3.847072E-06 1.255999E-05 7.6 -2.561859E-05 -6.498541E-07 2.376334E-06 5.638421E-06 1.314528E-05 7.8 -1.792437E-05 1.265536E-06 3.966837E-06 6.811941E-06 1.319781E-05 8.0 -1.185435E-05 2.631665E-06 4.998613E-06 7.446903E-06 1.283078E-05 8.2 -7.217376E-06 3.521118E-06 5.568077E-06 7.654346E-06 1.216114E-05 8.4 -3.779998E-06 4.026853E-06 5.779697E-06 7.543649E-06 1.129255E-05 8.6 -1.310085E-06 4.238792E-06 5.727893E-06 7.209414E-06 1.030981E-05 8.8 4.015161E-07 4.235011E-06 5.491519E-06 6.728477E-06 9.278800E-06 9.0 1.532811E-06 4.079812E-06 5.133740E-06 6.160986E-06 8.248537E-06 9.2 2.229797E-06 3.824501E-06 4.703759E-06 5.552708E-06 7.253919E-06 9.4 2.609094E-06 3.508992E-06 4.238940E-06 4.937446E-06 6.318396E-06 9.6 2.761911E-06 3.163529E-06 3.766807E-06 4.339227E-06 5.456303E-06 9.8 2.758279E-06 2.810294E-06 3.306799E-06 3.774137E-06 4.674798E-06 10.0 2.651009E-06 2.464842E-06 2.871806E-06 3.251926E-06 3.975564E-06 10.2 2.479206E-06 2.137471E-06 2.469616E-06 2.777530E-06 3.356534E-06 10.4 2.271289E-06 1.834530E-06 2.104349E-06 2.352625E-06 2.813799E-06 10.6 2.047504E-06 1.559620E-06 1.777798E-06 1.977167E-06 2.344287E-06 10.8 1.821952E-06 1.314735E-06 1.490927E-06 1.651501E-06 1.948956E-06 11.0 1.604338E-06 1.101953E-06 1.246036E-06 1.378012E-06 1.618164E-06 11.2 1.401777E-06 9.225931E-07 1.039933E-06 1.142834E-06 1.307248E-06 11.4 1.216598E-06 7.551469E-07 8.374223E-07 9.068623E-07 1.025196E-06 11.6 1.033170E-06 5.855887E-07 6.501537E-07 7.088056E-07 8.131198E-07 11.8 8.770529E-07 4.820340E-07 5.380772E-07 5.873812E-07 6.709660E-07 12.0 7.745297E-07 4.255046E-07 4.704086E-07 5.086019E-07 5.699818E-07 12.2 6.449119E-07 3.421657E-07 3.840255E-07 4.195645E-07 4.748879E-07 12.4 5.342224E-07 2.456890E-07 2.776267E-07 3.088006E-07 3.660731E-07 12.6 4.530050E-07 1.934824E-07 2.089665E-07 2.231065E-07 2.582069E-07 12.8 3.790569E-07 1.552948E-07 1.703625E-07 1.808294E-07 1.892878E-07 13.0 3.159291E-07 1.195291E-07 1.318364E-07 1.421955E-07 1.547714E-07 13.2 2.624936E-07 9.069580E-08 1.000184E-07 1.078553E-07 1.197511E-07 13.4 2.174589E-07 6.774370E-08 7.473634E-08 8.057400E-08 8.926421E-08 13.6 1.796549E-07 4.962212E-08 5.480693E-08 5.910350E-08 6.533354E-08 13.8 1.480361E-07 3.544118E-08 3.923150E-08 4.234711E-08 4.672381E-08 14.0 1.216794E-07 2.445317E-08 2.717486E-08 2.939153E-08 3.238309E-08 14.2 9.977774E-08 1.603444E-08 1.794335E-08 1.948098E-08 2.144699E-08 14.4 8.163137E-08 9.668463E-09 1.096453E-08 1.199382E-08 1.320907E-08 14.6 6.663775E-08 4.930272E-09 5.768960E-09 6.421762E-09 7.095082E-09 14.8 5.428134E-08 1.472521E-09 1.974077E-09 2.351672E-09 2.640713E-09 15.0 4.412348E-08 -9.868571E-10 -7.300027E-10 -5.502914E-10 -5.273702E-10 15.2 3.579271E-08 -2.675425E-09 -2.592706E-09 -2.552266E-09 -2.707674E-09 15.4 2.897590E-08 -3.775549E-09 -3.813518E-09 -3.868280E-09 -4.137462E-09 15.6 2.341014E-08 -4.432364E-09 -4.550907E-09 -4.668058E-09 -5.004145E-09 15.8 1.887550E-08 -4.760521E-09 -4.929864E-09 -5.085254E-09 -5.454756E-09 16.0 1.518860E-08 -4.849871E-09 -5.048210E-09 -5.224320E-09 -5.603800E-09 16.2 1.219706E-08 -4.770218E-09 -4.981851E-09 -5.166207E-09 -5.539718E-09 16.4 9.774580E-09 -4.575255E-09 -4.789124E-09 -4.973056E-09 -5.330180E-09 16.6 7.816806E-09 -4.305816E-09 -4.514364E-09 -4.692049E-09 -5.026404E-09 17.0 4.966573E-09 -3.658054E-09 -3.843055E-09 -3.998644E-09 -4.279068E-09 17.5 2.780697E-09 -2.824686E-09 -2.971532E-09 -3.093755E-09 -3.306838E-09 18.0 1.531625E-09 -2.092274E-09 -2.202568E-09 -2.293758E-09 -2.449595E-09 18.5 8.275176E-10 -1.504366E-09 -1.584271E-09 -1.650072E-09 -1.761301E-09 19.0 4.365468E-10 -1.057677E-09 -1.114128E-09 -1.160532E-09 -1.238697E-09 19.5 2.231956E-10 -7.306825E-10 -7.698439E-10 -8.020462E-10 -8.564658E-10 20.0 1.091893E-10 -4.976989E-10 -5.245032E-10 -5.466016E-10 -5.843171E-10