{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.8443115 -5.4239559 -2.2020117 ] [ -3.1881442 7.3491039 2.288533 ] [ -0.3974398 -1.7981468 1.1214888 ] [ 0.4386243 -1.8977018 -0.902907 ] [ 0.6115948 0.6206161 0.2610927 ] [ -1.618127 1.5775335 -3.6700088 ] [ 0.3091803 -0.4274488 3.1038129 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.159266008372579e-09 -8.690135335230223e-09 -3.528011664468063e-09 ] [ -5.107970100979119e-09 1.17745624524101e-08 3.666634068529287e-09 ] [ -6.367687557354279e-10 -2.880948763726334e-09 1.796823135849047e-09 ] [ 7.027535987747654e-10 -3.040453457210078e-09 -1.446616486156666e-09 ] [ 9.798828899628517e-10 9.943366059120748e-10 4.183166198015482e-10 ] [ -2.592525248885241e-09 2.527487292228797e-09 -5.880002297490263e-09 ] [ 4.953614482719302e-10 -6.848484739490151e-10 4.972856463717449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.260597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.047193794085062e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3277574 1.2221 2.0612484 ] [ 1.2341622 3.2637366 2.7563145 ] [ 2.5016637 1.9681349 4.3498415 ] [ 3.1329529 3.357547 1.2619432 ] [ 4.6166598 2.855136 5.0721103 ] [ 4.4628881 2.0650306 2.8063327 ] [ 3.333334 4.173798 3.5242554 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3277574e-10 1.2221e-10 2.0612484e-10 ] [ 1.2341622e-10 3.2637366e-10 2.7563145e-10 ] [ 2.5016637e-10 1.9681349e-10 4.3498415e-10 ] [ 3.1329529e-10 3.357547e-10 1.2619432e-10 ] [ 4.6166598e-10 2.855136e-10 5.072110300000001e-10 ] [ 4.4628881e-10 2.0650306e-10 2.8063327e-10 ] [ 3.333334e-10 4.173798e-10 3.5242554e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.8e-06 7.2e-06 -1.22e-05 ] [ 8.3e-06 -3.7e-06 4.2e-06 ] [ -6.9e-06 6.6e-06 4.3e-06 ] [ -8.8e-06 -6.6e-06 1.4e-06 ] [ 5.9e-06 -9.7e-06 -8.2e-06 ] [ 6.1e-06 -8e-07 1.61e-05 ] [ -8.3e-06 7.1e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.08827115904e-15 1.153567166976e-14 -1.954655477376e-14 ] [ 1.329806595264e-14 -5.928053496960001e-15 6.72914180736e-15 ] [ -1.105501868352e-14 1.057436569728e-14 6.889359469440001e-15 ] [ -1.409915426304e-14 -1.057436569728e-14 2.24304726912e-15 ] [ 9.45284206272e-15 -1.554111322176e-14 -1.313784829056e-14 ] [ 9.77327738688e-15 -1.28174129664e-15 2.579504359488e-14 ] [ -1.329806595264e-14 1.137545400768e-14 -8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -29.696935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973496641725e-18 } }