{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1396025 -6.3615609 -0.4363389 ] [ -2.1094986 6.7311372 -0.9789497 ] [ 3.6505878 -3.5683142 0.7122463 ] [ -4.4974186 -4.9184151 -1.8621636 ] [ 1.7680208 -1.6250816 -2.1302944 ] [ 0.6056625 7.7605479 1.1840978 ] [ 3.7222486 1.9816868 3.5114026 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.030197724105233e-09 -1.019234414577541e-08 -6.990919843255892e-10 ] [ -3.379789338530331e-09 1.078447065323717e-08 -1.568450322279174e-09 ] [ 5.848886425337706e-09 -5.717069586908656e-09 1.141144370111303e-09 ] [ -7.205658934871066e-09 -7.880169684609694e-09 -2.983514984024763e-09 ] [ 2.832681590848112e-09 -2.603667746412257e-09 -3.413107883101163e-09 ] [ 9.7037829759528e-10 1.243376840997854e-08 1.897133811900714e-09 ] [ 5.963699683725531e-09 3.175012260707966e-09 5.625887151936334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.909838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.068384062191543e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4932955 2.5713935 3.2288402 ] [ 2.6063115 5.0984648 3.1856086 ] [ 6.2031916 2.7085828 1.2358703 ] [ 3.6405322 2.4246457 0.9748527 ] [ 4.9918791 1.6252804 3.1749226 ] [ 4.6982627 4.7036964 1.7714026 ] [ 4.6169004 3.8773463 4.272975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4932955e-10 2.5713935e-10 3.2288402e-10 ] [ 2.6063115e-10 5.098464800000001e-10 3.1856086e-10 ] [ 6.203191600000001e-10 2.7085828e-10 1.2358703e-10 ] [ 3.6405322e-10 2.4246457e-10 9.748527e-11 ] [ 4.9918791e-10 1.6252804e-10 3.1749226e-10 ] [ 4.6982627e-10 4.7036964e-10 1.7714026e-10 ] [ 4.6169004e-10 3.8773463e-10 4.272975e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.15e-05 -1.94e-05 -1.3e-05 ] [ -1.25e-05 1.5e-05 4.9e-06 ] [ -3.1e-06 -8.8e-06 -1e-06 ] [ 4.3e-06 1.09e-05 5.5e-06 ] [ 6.5e-06 -6e-06 -2.9e-06 ] [ 1.8e-06 -5.7e-06 -8.7e-06 ] [ 1.45e-05 1.4e-05 1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.84250311392e-14 -3.108222644352e-14 -2.08282960704e-14 ] [ -2.002720776e-14 2.4032649312e-14 7.850665441919999e-15 ] [ -4.96674752448e-15 -1.409915426304e-14 -1.6021766208e-15 ] [ 6.889359469440001e-15 1.746372516672e-14 8.8119714144e-15 ] [ 1.04141480352e-14 -9.6130597248e-15 -4.646312200320001e-15 ] [ 2.88391791744e-15 -9.13240673856e-15 -1.393893660096e-14 ] [ 2.32315610016e-14 2.24304726912e-14 2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.527058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.647926593820561e-18 } }