{ "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" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4358149 -6.4293585 -1.7719408 ] [ -0.9942236 2.4193832 3.8850851 ] [ 1.1644108 2.8885491 -1.0158957 ] [ 1.8811245 1.5675496 -1.111883 ] [ 2.35995 -0.734524 0.8835665 ] [ -2.9754468 0.2884005 -0.8689321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.300429083529046e-09 -1.030096796030929e-08 -2.838962146591267e-09 ] [ -1.592921820891362e-09 3.876279231732149e-09 6.224592568321553e-09 ] [ 1.865591776137247e-09 4.627965874181729e-09 -1.627644353121074e-09 ] [ 3.013893719544933e-09 2.511491341756046e-09 -1.781432962341822e-09 ] [ 3.781056747408299e-09 -1.176837189912216e-09 1.415629600885161e-09 ] [ -4.76719133867007e-09 4.620685423339169e-10 -1.392182707152551e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.421588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.791246122077479e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9471738 0.0664522 1.409764 ] [ -0.1153659 1.7017773 3.005057 ] [ 0.4790988 2.4274772 0.5964049 ] [ 2.6972483 1.4021612 0.1416296 ] [ 3.3018885 0.1222137 2.3044487 ] [ 2.2360837 2.4017212 2.4314503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.471738e-11 6.64522e-12 1.409764e-10 ] [ -1.153659e-11 1.7017773e-10 3.005057e-10 ] [ 4.790988e-11 2.4274772e-10 5.964049e-11 ] [ 2.6972483e-10 1.4021612e-10 1.416296e-11 ] [ 3.3018885e-10 1.222137e-11 2.3044487e-10 ] [ 2.2360837e-10 2.4017212e-10 2.4314503e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.08e-05 -1.52e-05 -8.3e-06 ] [ 5.28e-05 4.5e-06 -2.65e-05 ] [ -4.05e-05 -2.74e-05 1.91e-05 ] [ 5.38e-05 5e-07 -5.9e-06 ] [ -1.62e-05 -1.59e-05 -1.09e-05 ] [ -9.1e-06 5.35e-05 3.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.53688066672e-14 -2.43530848368e-14 -1.32980660622e-14 ] [ 8.45949262752e-14 7.209794853e-15 -4.2457680801e-14 ] [ -6.4888153677e-14 -4.389963977159999e-14 3.06015737094e-14 ] [ 8.619710290919999e-14 8.010883169999999e-16 -9.452842140600001e-15 ] [ -2.59552614708e-14 -2.54746084806e-14 -1.74637253106e-14 ] [ -1.45798073694e-14 8.571644991899998e-14 5.207074060499999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.62566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304595051282844e-18 } }