{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.4978369e-10 9.451625000000001e-11 2.1808862e-10 ] [ 1.2183509e-10 1.236919e-10 4.2032707e-10 ] [ 1.9958327e-10 3.1505857e-10 5.434071000000001e-10 ] [ 2.2462725e-10 3.1771983e-10 3.0669434e-10 ] [ 4.706839399999999e-10 1.211218e-11 2.5131782e-10 ] [ 4.4200757e-10 2.4968381e-10 2.2765297e-10 ] [ 3.6422769e-10 1.5096171e-10 4.3741768e-10 ] ] "source-value" [ [ 2.4978369 0.9451625 2.1808862 ] [ 1.2183509 1.236919 4.2032707 ] [ 1.9958327 3.1505857 5.434071 ] [ 2.2462725 3.1771983 3.0669434 ] [ 4.7068394 0.1211218 2.5131782 ] [ 4.4200757 2.4968381 2.2765297 ] [ 3.6422769 1.5096171 4.3741768 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.498431298220161e-12 6.2709192938112e-13 5.80500633248256e-12 ] [ 5.013531081807361e-12 6.89592839358528e-12 -2.95265129447232e-12 ] [ -2.06136044032128e-12 -1.99198619264064e-12 1.040886085235136e-11 ] [ 4.30456792710336e-12 -4.761508699355521e-12 -5.343579465692159e-12 ] [ 3.418404038138879e-12 1.5845526779712e-12 -3.75406004019648e-12 ] [ -7.4308951672704e-12 -8.19465276240576e-12 4.95184728190656e-12 ] [ -7.742678737678081e-12 5.84057465346432e-12 -9.115263448717441e-12 ] ] "source-value" [ [ 0.0028077 0.0003914 0.0036232 ] [ 0.0031292 0.0043041 -0.0018429 ] [ -0.0012866 -0.0012433 0.0064967 ] [ 0.0026867 -0.0029719 -0.0033352 ] [ 0.0021336 0.000989 -0.0023431 ] [ -0.004638 -0.0051147 0.0030907 ] [ -0.0048326 0.0036454 -0.0056893 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.628681207914069e-18 "source-value" -28.889956 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.371660935205142e-09 -3.319813298689642e-09 -3.416039065228917e-09 ] [ -3.186282451711659e-09 -3.593185806137277e-09 2.072986795187778e-09 ] [ 2.967172141621955e-09 4.359504801036309e-09 5.330970335686464e-10 ] [ -3.411199850963453e-09 3.081304314728277e-09 7.495767458864255e-09 ] [ -2.403439888886992e-09 3.653201419740499e-10 -1.403591154528716e-09 ] [ 4.623426068597845e-09 -2.800007922367152e-09 -5.40744703232711e-10 ] [ -5.961336953862837e-09 1.906877929673096e-09 -4.741476204412672e-09 ] ] "source-value" [ [ 4.6010289 -2.0720645 -2.1321239 ] [ -1.9887211 -2.2426902 1.2938566 ] [ 1.8519632 2.7209889 0.332733 ] [ -2.1291035 1.9231989 4.6784901 ] [ -1.5001092 0.2280149 -0.8760527 ] [ 2.8857156 -1.7476275 -0.3375063 ] [ -3.7207739 1.1901796 -2.9593967 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.033894606608788e-18 "source-value" -25.17759 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.246807e-10 1.041122e-10 2.124463e-10 ] [ 1.267764e-10 1.326115e-10 3.99765e-10 ] [ 2.011294e-10 2.700157e-10 5.439591000000001e-10 ] [ 2.31677e-10 3.176049e-10 2.822929e-10 ] [ 4.533635000000001e-10 1.687206e-11 2.857812e-10 ] [ 4.258439e-10 2.493804e-10 2.204153e-10 ] [ 4.092776e-10 1.731475e-10 4.602458e-10 ] ] "source-value" [ [ 2.246807 1.041122 2.124463 ] [ 1.267764 1.326115 3.99765 ] [ 2.011294 2.700157 5.439591 ] [ 2.31677 3.176049 2.822929 ] [ 4.533635 0.1687206 2.857812 ] [ 4.258439 2.493804 2.204153 ] [ 4.092776 1.731475 4.602458 ] ] } "instance-id" 1 }