{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2422976 0.2155702 0.7539187 ] [ 0.1069263 2.303076 0.5134626 ] [ 0.4438839 2.233015 2.726304 ] [ 2.36111 0.1695128 0.2725886 ] [ 2.483594 1.001172 2.982027 ] [ 2.63043 2.516837 1.068712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.422976e-11 2.155702e-11 7.539187e-11 ] [ 1.069263e-11 2.303076e-10 5.134626e-11 ] [ 4.438839e-11 2.233015e-10 2.726304e-10 ] [ 2.36111e-10 1.695128e-11 2.725886e-11 ] [ 2.483594e-10 1.001172e-10 2.982027e-10 ] [ 2.63043e-10 2.516837e-10 1.068712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6036423 -6.3412688 -2.0602034 ] [ -3.8964007 5.2794991 -2.915938 ] [ -3.1092882 2.1986378 6.4802673 ] [ 4.00309 -3.329163 -1.9251404 ] [ 1.6769195 -1.0895558 3.1465541 ] [ 4.9293218 3.2818507 -2.7255397 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.773671442785941e-09 -1.015983261756847e-08 -3.300809721572671e-09 ] [ -6.242722106808755e-09 8.45869002755464e-09 -4.671847691302311e-09 ] [ -4.981628861369315e-09 3.522606080767147e-09 1.038253276459474e-08 ] [ 6.413657208958273e-09 -5.33390712543239e-09 -3.08441494063756e-09 ] [ 2.686721217863626e-09 -1.745660829817041e-09 5.041335415102385e-09 ] [ 7.897644144359775e-09 5.258104464496114e-09 -4.366795986402246e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7512576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.612353846118318e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2409097 0.104112 0.227751 ] [ 0.1251483 2.5098681 0.7846266 ] [ 0.49568 2.273413 3.1351257 ] [ 2.6260974 0.2608471 0.8582235 ] [ 2.2756077 0.6727541 3.1875026 ] [ 2.5047987 2.6181886 0.1237835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.409097e-11 1.04112e-11 2.27751e-11 ] [ 1.251483e-11 2.5098681e-10 7.846266e-11 ] [ 4.956800000000001e-11 2.273413e-10 3.1351257e-10 ] [ 2.6260974e-10 2.608471e-11 8.582235000000001e-11 ] [ 2.2756077e-10 6.727541e-11 3.1875026e-10 ] [ 2.5047987e-10 2.6181886e-10 1.237835e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 -9.1e-06 6e-07 ] [ -4.9e-06 1.3e-05 -2.4e-06 ] [ 1.61e-05 -2.01e-05 -1.7e-05 ] [ -7.7e-06 -6.7e-06 1.6e-06 ] [ -6e-07 1.58e-05 5.2e-06 ] [ 1.6e-06 7.2e-06 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012455680001e-15 -1.457980724928e-14 9.6130597248e-16 ] [ -7.850665441919999e-15 2.08282960704e-14 -3.84522388992e-15 ] [ 2.579504359488e-14 -3.220375007808e-14 -2.72370025536e-14 ] [ -1.233675998016e-14 -1.073458335936e-14 2.56348259328e-15 ] [ -9.6130597248e-16 2.531439060864e-14 8.33131842816e-15 ] [ 2.56348259328e-15 1.153567166976e-14 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }