{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0216645 -0.3692783 -1.596106 ] [ 0.0146073 -0.8356691 1.9902909 ] [ 0.8661471 -0.3372141 -0.9610617 ] [ -0.0363302 1.3173581 1.6815283 ] [ -0.9556782 -0.3193264 0.8375381 ] [ 0.8621114 2.2295974 -1.1931481 ] [ 0.2708071 -1.6854677 -0.7590415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.636886976201321e-09 -5.916490588287687e-10 -2.557243717518605e-09 ] [ 2.340347455301184e-11 -1.338889494744977e-09 3.188797548570991e-09 ] [ 1.38772063379372e-09 -5.402765472241133e-10 -1.539790586886303e-09 ] [ -5.820739706898816e-11 2.110640349041509e-09 2.694105329473569e-09 ] [ -1.531165269048227e-09 -5.116172924842291e-10 1.341883962849252e-09 ] [ 1.381254729605157e-09 3.572208828076466e-09 -1.91163399097194e-09 ] [ 4.338808043666477e-10 -2.700416944053548e-09 -1.216118545516963e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.085526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.897620693207054e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.230113 1.7273822 1.4455876 ] [ 2.1050608 1.3278063 3.7636061 ] [ 4.2097207 1.0933019 2.6182417 ] [ 3.8703042 2.779848 4.3381853 ] [ 5.0866235 3.2772506 2.2909989 ] [ 3.0968806 3.8860824 1.1221178 ] [ 3.5126293 4.8333861 3.2383137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.230113e-10 1.7273822e-10 1.4455876e-10 ] [ 2.1050608e-10 1.3278063e-10 3.7636061e-10 ] [ 4.2097207e-10 1.0933019e-10 2.6182417e-10 ] [ 3.8703042e-10 2.779848e-10 4.3381853e-10 ] [ 5.0866235e-10 3.2772506e-10 2.2909989e-10 ] [ 3.0968806e-10 3.8860824e-10 1.1221178e-10 ] [ 3.5126293e-10 4.8333861e-10 3.2383137e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -3.7e-06 -1.44e-05 ] [ -6.6e-06 -1.06e-05 7.5e-06 ] [ -6.5e-06 -2.94e-05 1.89e-05 ] [ 4.9e-06 6e-06 1.03e-05 ] [ 2.37e-05 2.06e-05 -2.02e-05 ] [ 2e-07 1.71e-05 -1.28e-05 ] [ -7.2e-06 -0.0 1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -5.928053496960001e-15 -2.307134333952e-14 ] [ -1.057436569728e-14 -1.698307218048e-14 1.2016324656e-14 ] [ -1.04141480352e-14 -4.710399265152e-14 3.028113813312e-14 ] [ 7.850665441919999e-15 9.6130597248e-15 1.650241919424e-14 ] [ 3.797158591296e-14 3.300483838848e-14 -3.236396774016e-14 ] [ 3.2043532416e-16 2.739722021568e-14 -2.050786074624e-14 ] [ -1.153567166976e-14 0.0 1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.037892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.370641871331535e-18 } }