{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1466203 -2.2131776 -2.3674816 ] [ -1.7319601 -0.6581423 2.4929229 ] [ -0.3204426 1.5958983 -1.0235302 ] [ 0.8896037 -0.3750382 -0.7482815 ] [ 2.3094192 1.6504598 1.6463705 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.837088237594682e-09 -3.545901408398254e-09 -3.793123669694177e-09 ] [ -2.77490598037843e-09 -1.05446020621954e-09 3.994102787836937e-09 ] [ -5.134056420283662e-10 2.556910945434465e-09 -1.639876157122748e-09 ] [ 1.425302249917177e-09 -6.008774359469146e-10 -1.198879125077155e-09 ] [ 3.700097449866639e-09 2.644328105130244e-09 2.637776324274806e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.244714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.641384125758245e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9732556 1.6589142 2.1638685 ] [ 1.6775258 1.9804651 4.5136165 ] [ 2.2855336 4.1018518 2.2426299 ] [ 4.3169302 1.3782252 2.8710156 ] [ 4.0763027 3.6485747 3.9890936 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9732556e-10 1.6589142e-10 2.1638685e-10 ] [ 1.6775258e-10 1.9804651e-10 4.5136165e-10 ] [ 2.2855336e-10 4.1018518e-10 2.2426299e-10 ] [ 4.3169302e-10 1.3782252e-10 2.8710156e-10 ] [ 4.0763027e-10 3.6485747e-10 3.9890936e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 6.4e-06 -1.78e-05 ] [ -1.58e-05 2.4e-06 2.54e-05 ] [ -3.69e-05 1.96e-05 -2.87e-05 ] [ 3.91e-05 -4.59e-05 -1.17e-05 ] [ 2.05e-05 1.75e-05 3.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 1.025393037312e-14 -2.851874385024e-14 ] [ -2.531439060864e-14 3.84522388992e-15 4.069528616832e-14 ] [ -5.912031730752001e-14 3.140266176767999e-14 -4.598246901696e-14 ] [ 6.264510587328001e-14 -7.353990689472e-14 -1.874546646336e-14 ] [ 3.28446207264e-14 2.8038090864e-14 5.255139316223999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.809519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.052311186549339e-18 } }