{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2147353 -2.9434397 -2.609642 ] [ -0.9076924 -3.3290794 -1.7426711 ] [ 2.5050187 -3.1773065 0.9280773 ] [ -1.5169286 2.0222237 -4.5761118 ] [ 11.0170825 -2.1133614 -0.8295673 ] [ -6.6190481 11.6035211 -3.4215282 ] [ 0.7363031 -2.0625578 12.2514431 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.354927050154979e-09 -4.715910310927968e-09 -4.181107435505028e-09 ] [ -1.454283554139381e-09 -5.333773227410739e-09 -2.792066917167077e-09 ] [ 4.013482428873055e-09 -5.090606233356321e-09 1.486943764605808e-09 ] [ -2.430387558366332e-09 3.239959560861025e-09 -7.331739400531681e-09 ] [ 1.765131215635031e-08 -3.385978254277527e-09 -1.329113344390468e-09 ] [ -1.060488420514209e-08 1.859089037854597e-08 -5.481892534612079e-09 ] [ 1.179687622361765e-09 -3.304581913434445e-09 1.962897586760052e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.864214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.740638981757568e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8312174 2.2081468 2.9408836 ] [ 3.4873336 1.6837748 1.0968582 ] [ 4.3565149 1.5234221 3.6187227 ] [ 3.5580077 4.1124754 0.3917653 ] [ 5.2914733 3.3833173 2.1748497 ] [ 3.0294881 4.5541608 2.8529987 ] [ 3.049129 3.1834529 5.0100469 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8312174e-10 2.2081468e-10 2.9408836e-10 ] [ 3.4873336e-10 1.6837748e-10 1.0968582e-10 ] [ 4.3565149e-10 1.5234221e-10 3.6187227e-10 ] [ 3.5580077e-10 4.1124754e-10 3.917653e-11 ] [ 5.2914733e-10 3.3833173e-10 2.1748497e-10 ] [ 3.0294881e-10 4.5541608e-10 2.8529987e-10 ] [ 3.049129e-10 3.1834529e-10 5.0100469e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-06 6.7e-06 1.51e-05 ] [ 1.4e-06 -1.01e-05 -6e-07 ] [ -1.19e-05 -1.7e-06 -6.5e-06 ] [ 3.3e-06 6e-06 -1.08e-05 ] [ 1.33e-05 1.08e-05 5.4e-06 ] [ -8.7e-06 -5.5e-06 -4.9e-06 ] [ 3.9e-06 -6.3e-06 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.0828296242e-15 1.07345834478e-14 2.41928671734e-14 ] [ 2.2430472876e-15 -1.61819840034e-14 -9.613059803999998e-16 ] [ -1.90659019446e-14 -2.7237002778e-15 -1.0414148121e-14 ] [ 5.2871828922e-15 9.613059803999999e-15 -1.73035076472e-14 ] [ 2.13089492322e-14 1.73035076472e-14 8.6517538236e-15 ] [ -1.39389367158e-14 -8.811971486999999e-15 -7.850665506599998e-15 ] [ 6.248488872599999e-15 -1.00937127942e-14 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.527058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.647926615636277e-18 } }