{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.3611486 -9.8661817 -24.7020054 ] [ -21.830815 11.6422659 -7.9757921 ] [ 0.5976972 -11.604467 23.590392 ] [ -10.98677 20.0808498 -18.8870714 ] [ 6.8169302 -1.3769739 4.5354132 ] [ 11.5374534 2.5438633 -1.2127994 ] [ 8.5043556 -11.4193564 24.6518631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.589506947554651e-09 -1.58073656563048e-08 -3.957697553875536e-08 ] [ -3.497682140600995e-08 1.865296623811707e-08 -1.277862763498133e-08 ] [ 9.576164801576218e-10 -1.859240572424511e-08 3.779597453790736e-08 ] [ -1.760274603210681e-08 3.217306807535635e-08 -3.026042423246032e-08 ] [ 1.092192619206547e-08 -2.206155390031797e-09 7.266532994707714e-09 ] [ 1.848503810104947e-08 4.075718305771137e-09 -1.943118844400268e-09 ] [ 1.362547971728956e-08 -1.829582584866285e-08 3.949663871798221e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8098473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.0910578135278e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6050228 1.7238417 1.0354879 ] [ 0.4315687 2.9864952 1.9639465 ] [ 1.5953236 1.2518244 3.5549072 ] [ 2.6572812 4.2980119 2.2532076 ] [ 4.3069343 1.3770315 3.1739377 ] [ 4.826669 3.1893904 1.346428 ] [ 3.0267003 3.2280738 4.5312391 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6050228e-10 1.7238417e-10 1.0354879e-10 ] [ 4.315687000000001e-11 2.9864952e-10 1.9639465e-10 ] [ 1.5953236e-10 1.2518244e-10 3.5549072e-10 ] [ 2.6572812e-10 4.2980119e-10 2.2532076e-10 ] [ 4.3069343e-10 1.3770315e-10 3.1739377e-10 ] [ 4.826669e-10 3.189390400000001e-10 1.346428e-10 ] [ 3.0267003e-10 3.228073800000001e-10 4.5312391e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -6.9e-06 -8.1e-06 ] [ -1.9e-06 -7.2e-06 1.09e-05 ] [ 1.8e-06 5.4e-06 -8e-06 ] [ -2.46e-05 2.3e-05 9.7e-06 ] [ 9.1e-06 -2.25e-05 1.57e-05 ] [ 2.33e-05 3e-06 2.06e-05 ] [ 1.16e-05 5.2e-06 -4.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.092200878144e-14 -1.105501868352e-14 -1.297763062848e-14 ] [ -3.04413557952e-15 -1.153567166976e-14 1.746372516672e-14 ] [ 2.88391791744e-15 8.65175375232e-15 -1.28174129664e-14 ] [ -3.941354487168e-14 3.68500622784e-14 1.554111322176e-14 ] [ 1.457980724928e-14 -3.604897396800001e-14 2.515417294656e-14 ] [ 3.733071526464e-14 4.8065298624e-15 3.300483838848e-14 ] [ 1.858524880128e-14 8.33131842816e-15 -6.536880612864e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.847122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.820730134176534e-18 } }