{ "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" [ [ 0.4147919 0.1188417 2.672415 ] [ 0.6892124 1.667561 0.0898235 ] [ 0.5303116 1.702107 2.13154 ] [ 2.147495 1.160279 2.850921 ] [ 1.555523 2.957039 1.141113 ] [ 2.952569 2.336763 2.431712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.147919e-11 1.188417e-11 2.672415e-10 ] [ 6.892124e-11 1.667561e-10 8.98235e-12 ] [ 5.303116e-11 1.702107e-10 2.13154e-10 ] [ 2.147495e-10 1.160279e-10 2.850921e-10 ] [ 1.555523e-10 2.957039e-10 1.141113e-10 ] [ 2.952569e-10 2.336763e-10 2.431712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3967558 -3.5305811 -0.162233 ] [ -1.1787009 -2.1356942 -3.9657927 ] [ -4.4691425 1.508522 2.5556 ] [ 3.9484488 -1.4476153 2.539034 ] [ 1.2209275 4.4752114 -1.7545631 ] [ 2.8752228 1.1301571 0.7879549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.840026108526801e-09 -5.656614496258347e-09 -2.599259197222464e-10 ] [ -1.888487024895919e-09 -3.42175931641816e-09 -6.353900346879308e-09 ] [ -7.160355628523664e-09 2.416918680362458e-09 4.09452257211648e-09 ] [ 6.326112355785815e-09 -2.319335389572379e-09 4.067980914216307e-09 ] [ 1.956141496191792e-09 7.170079078217638e-09 -2.811119978538373e-09 ] [ 4.606614749751115e-09 1.810711283451128e-09 1.262442919024802e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4525114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.514459277292548e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5215132 -0.0237739 1.9625653 ] [ 0.6067544 1.1992046 0.0195473 ] [ 0.2790468 2.2208363 2.6849215 ] [ 2.1074179 0.9266198 3.4538889 ] [ 1.5102921 3.1119028 0.9253444 ] [ 3.2648786 2.5078011 2.2712571 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.215132e-11 -2.37739e-12 1.9625653e-10 ] [ 6.067544000000001e-11 1.1992046e-10 1.95473e-12 ] [ 2.790468e-11 2.2208363e-10 2.6849215e-10 ] [ 2.1074179e-10 9.266198e-11 3.4538889e-10 ] [ 1.5102921e-10 3.1119028e-10 9.253444e-11 ] [ 3.2648786e-10 2.5078011e-10 2.2712571e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 8.8e-06 2.1e-06 ] [ 7.9e-06 -2e-06 -9.1e-06 ] [ 7.7e-06 6e-07 7.3e-06 ] [ 1.2e-06 -2.03e-05 1.83e-05 ] [ -2.21e-05 1.26e-05 -2.4e-05 ] [ 8.7e-06 4e-07 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.6076181728e-15 1.409915426304e-14 3.36457090368e-15 ] [ 1.265719530432e-14 -3.2043532416e-15 -1.457980724928e-14 ] [ 1.233675998016e-14 9.6130597248e-16 1.169588933184e-14 ] [ 1.92261194496e-15 -3.252418540224e-14 2.931983216064e-14 ] [ -3.540810331968e-14 2.018742542208e-14 -3.84522388992e-14 ] [ 1.393893660096e-14 6.408706483200001e-16 8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.48669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961894251397715e-18 } }