{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.6990892e-10 2.3488321e-10 4.2944692e-10 ] [ 1.9339914e-10 5.3573414e-10 2.9735743e-10 ] [ 7.225825e-11 4.0030919e-10 1.4598304e-10 ] [ 2.2661173e-10 2.3193224e-10 8.36625e-11 ] [ 2.1528478e-10 4.0299869e-10 4.918722500000001e-10 ] [ 4.2247e-10 2.8617938e-10 2.0466308e-10 ] [ 4.1153093e-10 5.2232344e-10 2.0720378e-10 ] ] "source-value" [ [ 3.6990892 2.3488321 4.2944692 ] [ 1.9339914 5.3573414 2.9735743 ] [ 0.7225825 4.0030919 1.4598304 ] [ 2.2661173 2.3193224 0.836625 ] [ 2.1528478 4.0299869 4.9187225 ] [ 4.2247 2.8617938 2.0466308 ] [ 4.1153093 5.2232344 2.0720378 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.63309278107072e-12 -1.4275393691328e-12 2.40438645483456e-12 ] [ 1.81670807032512e-12 4.89272696459904e-12 -1.39597648970304e-12 ] [ -2.41992756805632e-12 -2.5923217724544e-12 2.86981876317696e-12 ] [ 2.25394207014144e-12 -1.8561216151968e-12 2.05911739305216e-12 ] [ -1.5973700909376e-13 -2.6267685698016e-12 2.6884523697024e-13 ] [ 2.32043239990464e-12 2.28614582021952e-12 -6.133132104422399e-12 ] [ 1.8216748178496e-12 1.32371832410496e-12 -7.28990362464e-14 ] ] "source-value" [ [ -0.0035159 -0.000891 0.0015007 ] [ 0.0011339 0.0030538 -0.0008713 ] [ -0.0015104 -0.001618 0.0017912 ] [ 0.0014068 -0.0011585 0.0012852 ] [ -9.97e-05 -0.0016395 0.0001678 ] [ 0.0014483 0.0014269 -0.003828 ] [ 0.001137 0.0008262 -4.55e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.70664556588457e-18 "source-value" -16.893553 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.825817665649501e-09 -2.988149952814607e-08 2.048588577236209e-08 ] [ -1.989948496349008e-08 4.001534916680205e-08 -4.251979043008194e-09 ] [ -3.843363762863251e-08 -1.180230045559302e-08 -8.071566665036434e-09 ] [ -5.605948704761126e-10 -2.235178531125798e-08 -4.750869862071019e-08 ] [ 1.015265086086573e-08 1.038473623810133e-08 4.671049567018659e-08 ] [ 1.63626465875827e-08 -7.89548104570403e-09 -6.234825458897818e-10 ] [ 2.75526021882831e-08 2.153098093579773e-08 -6.740654728121746e-09 ] ] "source-value" [ [ 3.0120385 -18.6505652 12.7862843 ] [ -12.4202817 24.9756167 -2.6538766 ] [ -23.98839 -7.3664166 -5.0378757 ] [ -0.3498958 -13.9508872 -29.6525976 ] [ 6.3367863 6.4816426 29.1543985 ] [ 10.2127608 -4.9279717 -0.3891472 ] [ 17.1969818 13.4385814 -4.2071858 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.074823850901187e-18 "source-value" 12.950032 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] } "instance-id" 1 }