{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.4492685 -4.7239711 -21.7005935 ] [ -12.8288554 -13.4192605 10.5004004 ] [ 22.5700484 -24.9960437 2.722837 ] [ 5.7358198 11.427502 31.2325988 ] [ 17.0411396 3.9833743 -5.5379766 ] [ -7.5364144 15.0081955 -22.3454705 ] [ -0.5324693 12.7202035 5.1282045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.917204638636189e-08 -7.56863605375486e-09 -3.476818356318444e-08 ] [ -2.055409219350383e-08 -2.150002544152492e-08 1.682349602991897e-08 ] [ 3.616120387680445e-08 -4.004807682863513e-08 4.36246578364921e-09 ] [ 9.189796384681731e-09 1.830887653854524e-08 5.004013960418614e-08 ] [ 2.730291545890906e-08 6.382069175355565e-09 -8.872816635057473e-09 ] [ -1.207466695634046e-08 2.404577995049577e-08 -3.580139041587609e-08 ] [ -8.531098637537414e-10 2.038001265951833e-08 8.216289356581354e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 17.476363 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.800022021521415e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7340043 2.1379482 1.578338 ] [ 2.7124226 1.2520141 3.5396838 ] [ 4.9383056 0.8912312 2.8263194 ] [ 2.8309401 3.1762241 4.90972 ] [ 5.3442583 2.6562863 1.3011448 ] [ 3.3145513 3.870097 1.2773345 ] [ 3.2368499 4.9412566 3.3845105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7340043e-10 2.1379482e-10 1.578338e-10 ] [ 2.7124226e-10 1.2520141e-10 3.5396838e-10 ] [ 4.9383056e-10 8.912312e-11 2.8263194e-10 ] [ 2.8309401e-10 3.1762241e-10 4.90972e-10 ] [ 5.3442583e-10 2.6562863e-10 1.3011448e-10 ] [ 3.3145513e-10 3.870097e-10 1.2773345e-10 ] [ 3.2368499e-10 4.9412566e-10 3.3845105e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.38e-05 2.7e-06 -2.79e-05 ] [ -8.1e-06 -1.6e-06 3.02e-05 ] [ 3.8e-05 7.2e-06 1.02e-05 ] [ -4.3e-06 -2.29e-05 -4.9e-06 ] [ -1.28e-05 -2.88e-05 -2.5e-06 ] [ -7.8e-06 3e-05 -1.22e-05 ] [ 8.9e-06 1.34e-05 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.211003736704e-14 4.32587687616e-15 -4.470072772032e-14 ] [ -1.297763062848e-14 -2.56348259328e-15 4.838573394816e-14 ] [ 6.08827115904e-14 1.153567166976e-14 1.634220153216e-14 ] [ -6.889359469440001e-15 -3.668984461632e-14 -7.850665441919999e-15 ] [ -2.050786074624e-14 -4.614268667904e-14 -4.005441552e-15 ] [ -1.249697764224e-14 4.8065298624e-14 -1.954655477376e-14 ] [ 1.425937192512e-14 2.146916671872e-14 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }