{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6830188 -4.3460582 2.3534729 ] [ -2.980138 3.3755441 -2.4277482 ] [ 3.6548701 -2.0377957 -7.2668374 ] [ 2.2956732 -3.1106841 3.4767382 ] [ 4.7126134 6.1189939 3.8643745 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.230955309852687e-08 -6.963152840676131e-09 3.770679258066376e-09 ] [ -4.774707430357671e-09 5.408217839499378e-09 -3.889681407229283e-09 ] [ 5.855747426280958e-09 -3.264908628506771e-09 -1.164275698943506e-08 ] [ 3.678073930037122e-09 -4.983865339714289e-09 5.570348660682275e-09 ] [ 7.5504390123488e-09 9.803708969397813e-09 6.191410477915689e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.1198321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.396345430641368e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0686559 2.5021751 3.2796449 ] [ 2.8623281 4.4196277 1.7855944 ] [ 4.5602238 2.6615088 1.0339919 ] [ 4.5908618 2.1747339 3.544136 ] [ 4.5509134 4.7278494 3.6809538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0686559e-10 2.5021751e-10 3.2796449e-10 ] [ 2.8623281e-10 4.419627700000001e-10 1.7855944e-10 ] [ 4.5602238e-10 2.6615088e-10 1.0339919e-10 ] [ 4.5908618e-10 2.1747339e-10 3.544136e-10 ] [ 4.5509134e-10 4.727849400000001e-10 3.6809538e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 1.31e-05 -5.6e-06 ] [ 1.13e-05 -2.22e-05 5.1e-06 ] [ -1.08e-05 1.13e-05 9.6e-06 ] [ 1.3e-06 8.4e-06 -5.7e-06 ] [ -6.4e-06 -1.06e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 2.098851373248e-14 -8.972189076479999e-15 ] [ 1.810459581504e-14 -3.556832098176e-14 8.17110076608e-15 ] [ -1.730350750464e-14 1.810459581504e-14 1.538089555968e-14 ] [ 2.08282960704e-15 1.345828361472e-14 -9.13240673856e-15 ] [ -1.025393037312e-14 -1.698307218048e-14 -5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }