{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3908195 -14.964509 26.9188514 ] [ -24.6686061 12.1398593 11.8811053 ] [ 22.3712583 -44.2125157 10.636984 ] [ 111.7944664 23.8815911 20.0044544 ] [ -95.1062992 23.1555742 -69.441395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.305663455705274e-08 -2.397578646155118e-08 4.312875437186935e-08 ] [ -3.952346396114427e-08 1.945019875026145e-08 1.903562914092297e-08 ] [ 3.584270702613796e-08 -7.083625900129296e-08 1.704232708062367e-08 ] [ 1.791144804008912e-07 3.826252692792535e-08 3.205066915153969e-08 ] [ -1.523770890690497e-07 3.709931962443966e-08 -1.11257379584738e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 44.271732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.093113397272323e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0355173 0.3430897 3.1078823 ] [ -0.1618896 2.0236999 1.9792138 ] [ 3.1382879 0.1308665 2.0756778 ] [ 3.2405057 1.6803896 0.3091394 ] [ 1.2008017 2.8500759 0.249386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0355173e-10 3.430897e-11 3.1078823e-10 ] [ -1.618896e-11 2.0236999e-10 1.9792138e-10 ] [ 3.1382879e-10 1.308665e-11 2.0756778e-10 ] [ 3.2405057e-10 1.6803896e-10 3.091394e-11 ] [ 1.2008017e-10 2.8500759e-10 2.49386e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 3e-07 -3.1e-06 ] [ -1.6e-06 -4.2e-06 -9.1e-06 ] [ 2.3e-06 6.8e-06 5.7e-06 ] [ -1.18e-05 -1.06e-05 -4.9e-06 ] [ 6.5e-06 7.7e-06 1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 4.8065298624e-16 -4.96674752448e-15 ] [ -2.56348259328e-15 -6.72914180736e-15 -1.457980724928e-14 ] [ 3.68500622784e-15 1.089480102144e-14 9.13240673856e-15 ] [ -1.890568412544e-14 -1.698307218048e-14 -7.850665441919999e-15 ] [ 1.04141480352e-14 1.233675998016e-14 1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }