{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -40.8831388 17.6986449 -35.6591987 ] [ 9.1327003 -10.027211 44.8350023 ] [ 33.0610171 -2.8869673 1.2444001 ] [ -25.4862997 38.8202007 -34.6028041 ] [ 24.1757211 -43.6046672 24.1826004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.550200917028136e-08 2.835635507862115e-08 -5.713233447360175e-08 ] [ 1.463219890543315e-08 -1.606536303602859e-08 7.183359247857423e-08 ] [ 5.296958865748902e-08 -4.6254315130741e-09 1.993748747141182e-09 ] [ -4.083355353004205e-08 6.21968179763038e-08 -5.543980374314238e-08 ] [ 3.873377513740126e-08 -6.98623783456046e-08 3.874479699102873e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.745884 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.522768721862879e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1578004 0.8729117 0.7263656 ] [ 0.3085228 0.3861635 3.3251833 ] [ 1.686934 -0.2510081 0.4036614 ] [ 1.648478 2.7658133 1.4857114 ] [ 2.5639749 1.2486039 2.2377298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.578004e-11 8.729116999999999e-11 7.263656e-11 ] [ 3.085228e-11 3.861635e-11 3.3251833e-10 ] [ 1.686934e-10 -2.510081e-11 4.036614e-11 ] [ 1.648478e-10 2.7658133e-10 1.4857114e-10 ] [ 2.5639749e-10 1.2486039e-10 2.2377298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.31e-05 1.55e-05 -4.35e-05 ] [ -6.9e-06 4.77e-05 3.57e-05 ] [ 6.9e-05 -0.0001406 -5.2e-05 ] [ 1.82e-05 2.72e-05 0.0001333 ] [ -1.72e-05 5.02e-05 -7.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.0109734477248e-13 2.48337376224e-14 -6.969468300480001e-14 ] [ -1.105501868352e-14 7.642382481215999e-14 5.719770536256001e-14 ] [ 1.105501868352e-13 -2.2526603288448e-13 -8.33131842816e-14 ] [ 2.915961449856e-14 4.357920408576e-14 2.1357014355264e-13 ] [ -2.755743787776e-14 8.042926636416e-14 -1.1792019929088e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.088346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.77654887245412e-18 } }