{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2919425 2.67516 1.746269 ] [ 2.438709 2.093987 1.463313 ] [ 1.581807 3.429392 0.2359452 ] [ 3.672756 4.324894 1.563989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.919425e-11 2.67516e-10 1.746269e-10 ] [ 2.438709e-10 2.093987e-10 1.463313e-10 ] [ 1.581807e-10 3.429392e-10 2.359452e-11 ] [ 3.672756e-10 4.324894e-10 1.563989e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1179117 -0.9885147 2.9300137 ] [ 5.3022308 -3.8879349 4.1209282 ] [ 0.8027846 6.6448767 -6.0454346 ] [ -1.9871038 -1.7684271 -1.0055073 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.597621852258783e-09 -1.583775141657126e-09 4.694399448763705e-09 ] [ 8.495110225845681e-09 -6.229158399972386e-09 6.602454818035427e-09 ] [ 1.28620271765828e-09 1.064626609683866e-08 -9.6858539786954e-09 ] [ -3.183691251462839e-09 -2.833332555209144e-09 -1.611000288103732e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.6168463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.380570968688698e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1776483 2.488646 1.6745271 ] [ 2.5309081 2.1114298 1.7496843 ] [ 1.5986954 3.7618069 0.2443312 ] [ 3.6779627 4.1615503 1.3409736 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.776483e-11 2.488646e-10 1.6745271e-10 ] [ 2.5309081e-10 2.1114298e-10 1.7496843e-10 ] [ 1.5986954e-10 3.7618069e-10 2.443312e-11 ] [ 3.6779627e-10 4.1615503e-10 1.3409736e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 2.2e-06 -1.6e-06 ] [ -3e-07 1.9e-06 -1.5e-06 ] [ -2.2e-06 -3.2e-06 2.1e-06 ] [ -2e-07 -8e-07 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 3.52478856576e-15 -2.56348259328e-15 ] [ -4.8065298624e-16 3.04413557952e-15 -2.4032649312e-15 ] [ -3.52478856576e-15 -5.126965186560001e-15 3.36457090368e-15 ] [ -3.2043532416e-16 -1.28174129664e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.766829 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.725036170395144e-18 } }