{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 98.7760001 123.1916683 -290.7525618 ] [ -108.9253126 -131.9214674 292.442151 ] [ -35.5563345 12.2851935 -282.2325895 ] [ 332.151355 -77.0382687 198.9044868 ] [ -286.445708 73.4828744 81.6385136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.582565980563585e-07 1.973748108276085e-07 -4.658369569536672e-07 ] [ -1.745175892610517e-07 -2.113614908499094e-07 4.685439772686634e-07 ] [ -5.696752785724445e-08 1.968304980770413e-08 -4.521864565247436e-07 ] [ 5.321651355480412e-07 -1.234289130180484e-07 3.186801185231822e-07 ] [ -4.589366164861036e-07 1.177325433928628e-07 1.307993178467828e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 228.26848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.657264219215524e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.5233114 1.4495862 0.7704875 ] [ 0.4536191 0.1120032 3.0025729 ] [ 2.9371126 1.756151 0.1608681 ] [ 3.4134841 2.8948768 2.3394053 ] [ 1.0256217 2.6506413 3.0677752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.233114e-11 1.4495862e-10 7.704875e-11 ] [ 4.536191e-11 1.120032e-11 3.0025729e-10 ] [ 2.9371126e-10 1.756151e-10 1.608681e-11 ] [ 3.4134841e-10 2.8948768e-10 2.3394053e-10 ] [ 1.0256217e-10 2.6506413e-10 3.0677752e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.81e-05 2.27e-05 -1.44e-05 ] [ 1.75e-05 -3.55e-05 -2.42e-05 ] [ -1.91e-05 -2.31e-05 8.29e-05 ] [ -3.88e-05 1.85e-05 -3.9e-06 ] [ 7.85e-05 1.73e-05 -4.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.104292925248e-14 3.636940929216e-14 -2.307134333952e-14 ] [ 2.8038090864e-14 -5.68772700384e-14 -3.877267422336e-14 ] [ -3.060157345728e-14 -3.701027994048e-14 1.3282044186432e-13 ] [ -6.216445288704e-14 2.96402674848e-14 -6.24848882112e-15 ] [ 1.257708647328e-13 2.771765553984e-14 -6.472793548032e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.615343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.501853748037294e-18 } }