{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.3494043 2.6150161 -1.1896778 ] [ -0.3004766 1.0314383 1.6807883 ] [ -6.4762204 -1.9780091 -1.3981203 ] [ 0.3997555 -2.815843 2.1564071 ] [ -1.3062902 0.1295129 -0.5194958 ] [ 4.3961919 1.9435887 1.1016772 ] [ -0.0623645 -0.925704 -1.8315787 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.366337263066989e-09 4.189717658435595e-09 -1.906073957444778e-09 ] [ -4.814165836174732e-10 1.652546330057697e-09 2.692919718774177e-09 ] [ -1.037604891602802e-08 -3.16911993574965e-09 -2.240035657725882e-09 ] [ 6.404789161362144e-10 -4.511477822443334e-09 3.454945040547128e-09 ] [ -2.092907618420156e-09 2.075025404720083e-10 -8.323240253637926e-10 ] [ 7.043475882730332e-09 3.113972375591065e-09 1.765081453508406e-09 ] [ -9.99189438678816e-11 -1.483141306581043e-09 -2.934512572295257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.585316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.817478216458017e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4272058 2.0664651 3.2297316 ] [ 3.1690222 5.2564584 2.5718424 ] [ 2.3418094 3.4558148 1.3058018 ] [ 4.42225 2.3123344 1.8532141 ] [ 5.4220649 3.177824 3.8993643 ] [ 5.3366641 4.5671847 1.9754403 ] [ 3.2542866 3.8694095 4.4925785 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4272058e-10 2.0664651e-10 3.2297316e-10 ] [ 3.1690222e-10 5.2564584e-10 2.5718424e-10 ] [ 2.3418094e-10 3.4558148e-10 1.3058018e-10 ] [ 4.42225e-10 2.3123344e-10 1.8532141e-10 ] [ 5.4220649e-10 3.177824000000001e-10 3.8993643e-10 ] [ 5.3366641e-10 4.567184700000001e-10 1.9754403e-10 ] [ 3.2542866e-10 3.869409500000001e-10 4.4925785e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.45e-05 -3.38e-05 0.0 ] [ 2.14e-05 1.2e-06 7.4e-06 ] [ 2.4e-06 9.5e-06 -1.49e-05 ] [ -2.44e-05 6.7e-06 8.3e-06 ] [ 4.5e-06 1.9e-06 7.2e-06 ] [ -5.6e-06 1.1e-06 -1.41e-05 ] [ -1.28e-05 1.35e-05 6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.32315610016e-14 -5.415356978304e-14 0.0 ] [ 3.428657968511999e-14 1.92261194496e-15 1.185610699392e-14 ] [ 3.84522388992e-15 1.52206778976e-14 -2.387243164992e-14 ] [ -3.909310954752e-14 1.073458335936e-14 1.329806595264e-14 ] [ 7.2097947936e-15 3.04413557952e-15 1.153567166976e-14 ] [ -8.972189076479999e-15 1.76239428288e-15 -2.259069035328e-14 ] [ -2.050786074624e-14 2.16293843808e-14 9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.906204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669978452007545e-18 } }