{ "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" [ [ -8.354926981320474e-09 -4.715910272074566e-09 -4.181107401057754e-09 ] [ -1.454283542157842e-09 -5.333773183466892e-09 -2.792066894163819e-09 ] [ 4.013482395806809e-09 -5.090606191415875e-09 1.486943752355188e-09 ] [ -2.430387538342875e-09 3.239959534167673e-09 -7.331739340127005e-09 ] [ 1.765131201092482e-08 -3.385978226381157e-09 -1.32911333344018e-09 ] [ -1.060488411777066e-08 1.85908902253795e-08 -5.481892489447907e-09 ] [ 1.179687612642565e-09 -3.304581886208682e-09 1.962897570588148e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.864214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.740638967416805e-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" [ [ -2.08282960704e-15 1.073458335936e-14 2.419286697408e-14 ] [ 2.24304726912e-15 -1.618198387008e-14 -9.6130597248e-16 ] [ -1.906590178752e-14 -2.72370025536e-15 -1.04141480352e-14 ] [ 5.28718284864e-15 9.6130597248e-15 -1.730350750464e-14 ] [ 2.130894905664e-14 1.730350750464e-14 8.65175375232e-15 ] [ -1.393893660096e-14 -8.8119714144e-15 -7.850665441919999e-15 ] [ 6.24848882112e-15 -1.009371271104e-14 3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.527058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.647926593820561e-18 } }