{ "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" [ [ 1.201304 1.645112 1.368441 ] [ 2.96083 0.196256 2.000233 ] [ 1.817638 2.196428 3.68098 ] [ 1.740873 3.89811 0.9150282 ] [ 4.00836 2.276208 0.7214657 ] [ 3.949621 2.27126 3.236775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.201304e-10 1.645112e-10 1.368441e-10 ] [ 2.96083e-10 1.96256e-11 2.000233e-10 ] [ 1.817638e-10 2.196428e-10 3.68098e-10 ] [ 1.740873e-10 3.89811e-10 9.150282e-11 ] [ 4.00836e-10 2.276208e-10 7.214657e-11 ] [ 3.949621e-10 2.27126e-10 3.236775e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2160595 0.4975253 0.5551811 ] [ 0.8835022 2.1777166 0.6710678 ] [ -2.2544993 -1.2505627 -0.6266339 ] [ 3.6747682 -2.6268183 -0.673656 ] [ -3.6098193 1.8694941 1.5567021 ] [ 2.5221078 -0.667355 -1.4826611 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.948342100401738e-09 7.971234039165063e-10 8.894981787300269e-10 ] [ 1.415526569265366e-09 3.489086623248066e-09 1.07516914013169e-09 ] [ -3.612106070069966e-09 -2.003622320784524e-09 -1.003978184380725e-09 ] [ 5.887627696899299e-09 -4.2086268673496e-09 -1.079315893661645e-09 ] [ -5.783568087772621e-09 2.995259739743538e-09 2.494111710170264e-09 ] [ 4.040862152297322e-09 -1.069220578773984e-09 -2.375484950989611e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.030441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.568359779131377e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7275048 1.8827003 1.6694782 ] [ 2.857508 0.7237003 1.818477 ] [ 1.8245606 1.7308425 3.8029107 ] [ 2.0053665 3.3491418 0.4036199 ] [ 4.1344468 2.5886304 0.9274714 ] [ 4.1292391 2.2083586 3.3009658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.275048e-11 1.8827003e-10 1.6694782e-10 ] [ 2.857508e-10 7.237003e-11 1.818477e-10 ] [ 1.8245606e-10 1.7308425e-10 3.8029107e-10 ] [ 2.0053665e-10 3.3491418e-10 4.036199e-11 ] [ 4.1344468e-10 2.5886304e-10 9.274713999999999e-11 ] [ 4.129239100000001e-10 2.2083586e-10 3.3009658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 4.08e-05 1.72e-05 ] [ 2.88e-05 7.7e-06 -1.9e-06 ] [ -6.3e-06 -2.82e-05 6.2e-06 ] [ -8e-06 -1.2e-05 -4e-05 ] [ -1.94e-05 -1.4e-06 -7.2e-06 ] [ -4e-07 -6.9e-06 2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 6.536880612864e-14 2.755743787776e-14 ] [ 4.614268667904e-14 1.233675998016e-14 -3.04413557952e-15 ] [ -1.009371271104e-14 -4.518138070656001e-14 9.93349504896e-15 ] [ -1.28174129664e-14 -1.92261194496e-14 -6.4087064832e-14 ] [ -3.108222644352e-14 -2.24304726912e-15 -1.153567166976e-14 ] [ -6.408706483200001e-16 -1.105501868352e-14 4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.34272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.938827714588058e-18 } }