{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9506018 -0.3583241 1.3170968 ] [ -3.2990988 7.6798061 0.7411628 ] [ -8.090203 -5.9179137 -7.1427514 ] [ 1.766598 -6.0558175 -1.7328642 ] [ 1.5216027 -0.880456 1.5332022 ] [ 8.314208 5.6833359 1.9856993 ] [ 0.7374948 -0.1506306 3.2984546 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.523031979650397e-09 -5.740984956892012e-10 2.110221700290493e-09 ] [ -5.285738967069335e-09 1.230440578569723e-08 1.187473710366666e-09 ] [ -1.296193410412602e-08 -9.481542974052026e-09 -1.144394930126647e-08 ] [ 2.830402013952038e-09 -9.702489218331505e-09 -2.776354508261296e-09 ] [ 2.437876272086157e-09 -1.410646018843085e-09 2.456460719799126e-09 ] [ 1.332082967806833e-08 9.105707907133328e-09 3.181440994398926e-09 ] [ 1.181596926521572e-09 -2.413368256970765e-10 5.284706844890216e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.641411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.704941991652395e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0179879 2.0082244 3.4465834 ] [ 3.1199142 5.3026844 2.5116906 ] [ 2.4683226 3.3191556 1.2835153 ] [ 4.5417386 2.1060029 1.7285002 ] [ 5.4104837 3.1078016 3.7804396 ] [ 5.5603941 4.9711699 2.0181344 ] [ 3.2544619 3.8904522 4.5591094 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0179879e-10 2.0082244e-10 3.4465834e-10 ] [ 3.1199142e-10 5.3026844e-10 2.5116906e-10 ] [ 2.4683226e-10 3.319155600000001e-10 1.2835153e-10 ] [ 4.541738600000001e-10 2.1060029e-10 1.7285002e-10 ] [ 5.410483700000001e-10 3.1078016e-10 3.7804396e-10 ] [ 5.5603941e-10 4.9711699e-10 2.0181344e-10 ] [ 3.2544619e-10 3.8904522e-10 4.5591094e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-05 -2.65e-05 1.79e-05 ] [ 5.09e-05 -6.58e-05 -4.87e-05 ] [ 5e-06 9.98e-05 -3.1e-06 ] [ -2.54e-05 -3.58e-05 5.7e-05 ] [ -5.9e-06 6.3e-05 -8.56e-05 ] [ -3.73e-05 -1.57e-05 6.01e-05 ] [ -2.03e-05 -1.9e-05 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-14 -4.24576804512e-14 2.867896151232001e-14 ] [ 8.155078999872e-14 -1.0542322164864e-13 -7.802600143296e-14 ] [ 8.010883104e-15 1.5989722675584e-13 -4.96674752448e-15 ] [ -4.069528616832e-14 -5.735792302464001e-14 9.13240673856e-14 ] [ -9.45284206272e-15 1.009371271104e-13 -1.3714631874048e-13 ] [ -5.976118795584e-14 -2.515417294656e-14 9.629081491008e-14 ] [ -3.252418540224e-14 -3.04413557952e-14 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.9983780561006e-18 } }