{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7413604 3.4639768 -10.688789 ] [ -7.9146719 -0.2505801 -0.6051846 ] [ -5.5835187 5.7676059 3.2220058 ] [ 5.2890708 -5.9833444 -4.3875476 ] [ 7.0556436 -6.6401067 8.5653688 ] [ 4.8150834 2.0233403 0.7830034 ] [ 0.0797531 1.6191083 3.1111432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.994320162866936e-09 5.549902643953597e-09 -1.712532784046421e-08 ] [ -1.268070227948272e-08 -4.01473577857726e-10 -9.696126173881998e-10 ] [ -8.945783122939609e-09 9.240723330968143e-09 5.162222364842001e-09 ] [ 8.474025581515953e-09 -9.586374511874604e-09 -7.02962618736715e-09 ] [ 1.130438722061715e-08 -1.063862371435744e-08 1.372323363988975e-08 ] [ 7.714614050682174e-09 3.241748524582459e-09 1.254509741486911e-09 ] [ 1.277785522563245e-10 2.594097464803232e-09 4.984600899000899e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.840227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736795826356493e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4754641 3.4848878 1.1628467 ] [ 0.6874129 1.9581049 4.1978878 ] [ 1.5827129 4.1615586 3.4450759 ] [ 6.2104646 1.7049661 1.7914182 ] [ 2.6549851 0.4288051 3.5733066 ] [ 4.0351488 2.2533424 2.6668383 ] [ 3.9224366 4.0127251 4.4284495 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4754641e-10 3.4848878e-10 1.1628467e-10 ] [ 6.874129000000001e-11 1.9581049e-10 4.197887800000001e-10 ] [ 1.5827129e-10 4.161558600000001e-10 3.4450759e-10 ] [ 6.2104646e-10 1.7049661e-10 1.7914182e-10 ] [ 2.6549851e-10 4.288051e-11 3.5733066e-10 ] [ 4.0351488e-10 2.2533424e-10 2.666838300000001e-10 ] [ 3.922436600000001e-10 4.0127251e-10 4.4284495e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.71e-05 2.45e-05 3.2e-05 ] [ 3.29e-05 3.58e-05 7.7e-06 ] [ -2.6e-05 -1.89e-05 4.4e-06 ] [ 8.24e-05 1.2e-05 2.6e-05 ] [ -9e-07 3.27e-05 -4.02e-05 ] [ -5.97e-05 -0.000115 -1.21e-05 ] [ 8.3e-06 2.89e-05 -1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.944075263168e-14 3.92533272096e-14 5.12696518656e-14 ] [ 5.271161082432e-14 5.735792302464001e-14 1.233675998016e-14 ] [ -4.16565921408e-14 -3.028113813312e-14 7.04957713152e-15 ] [ 1.3201935355392e-13 1.92261194496e-14 4.16565921408e-14 ] [ -1.44195895872e-15 5.239117550016001e-14 -6.440750015616e-14 ] [ -9.564994426176e-14 -1.84250311392e-13 -1.938633711168e-14 ] [ 1.329806595264e-14 4.630290434112001e-14 -2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.641215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.307087209790627e-18 } }