{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.5072316 -47.4917299 50.8780655 ] [ 0.2224998 -10.5751084 -38.7361335 ] [ -34.7507768 57.0954118 38.1395184 ] [ -15.1448258 27.0442356 1.992466 ] [ 17.3575712 -9.9453525 -12.6506955 ] [ 22.4467658 -11.9294569 -63.2232618 ] [ 3.3615342 -4.1979997 23.6000409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.042573433565098e-08 -7.609013932712832e-08 8.151564705563106e-08 ] [ 3.564839776926758e-10 -1.69431914409057e-08 -6.206212747388768e-08 ] [ -5.567688214359904e-08 9.147693394090845e-08 6.110624470905143e-08 ] [ -2.426468582284866e-08 4.332964200572706e-08 3.192282442938893e-09 ] [ 2.78098947705114e-08 -1.593421126111483e-08 -2.026864856695977e-08 ] [ 3.596368337733301e-08 -1.911309694402124e-08 -1.012948319466777e-07 ] [ 5.385771505259631e-09 -6.725936973465412e-09 3.781143377990379e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.260807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.367662763954098e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5050842 1.4256651 3.9334407 ] [ 1.8028806 2.9526193 1.3433077 ] [ 2.755836 5.4384534 3.0550697 ] [ 0.7671016 3.702138 4.0452281 ] [ 5.0239113 1.4229273 2.5656244 ] [ 4.4668431 3.8554054 1.2529877 ] [ 4.5184363 3.7165815 4.4145816 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5050842e-10 1.4256651e-10 3.9334407e-10 ] [ 1.8028806e-10 2.9526193e-10 1.3433077e-10 ] [ 2.755836e-10 5.438453400000001e-10 3.0550697e-10 ] [ 7.671016000000001e-11 3.702138e-10 4.0452281e-10 ] [ 5.0239113e-10 1.4229273e-10 2.5656244e-10 ] [ 4.4668431e-10 3.8554054e-10 1.2529877e-10 ] [ 4.518436300000001e-10 3.7165815e-10 4.4145816e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.38e-05 -2.18e-05 -1.11e-05 ] [ 2.14e-05 1.9e-06 3.49e-05 ] [ 9.2e-06 1.52e-05 -2.59e-05 ] [ -1.53e-05 -1.15e-05 2.22e-05 ] [ 2.6e-06 -8e-06 -8.8e-06 ] [ 1.53e-05 9.4e-06 -8e-06 ] [ -9.4e-06 1.47e-05 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.813180357504e-14 -3.492745033344e-14 -1.778416049088e-14 ] [ 3.428657968511999e-14 3.04413557952e-15 5.591596406592e-14 ] [ 1.474002491136e-14 2.435308463616e-14 -4.149637447872e-14 ] [ -2.451330229824e-14 -1.84250311392e-14 3.556832098176e-14 ] [ 4.16565921408e-15 -1.28174129664e-14 -1.409915426304e-14 ] [ 2.451330229824e-14 1.506046023552e-14 -1.28174129664e-14 ] [ -1.506046023552e-14 2.355199632576e-14 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.661456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.989894851328789e-18 } }