{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0842552 1.1458071 -1.5792971 ] [ 0.4363862 -0.4862186 2.4917555 ] [ 2.2058271 -1.0440915 -0.9968073 ] [ -0.7963411 1.8361784 -1.4266762 ] [ 1.238383 -1.4516755 1.511025 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.941521574020828e-09 1.835785347566648e-09 -2.53031289091724e-09 ] [ 6.99167767279753e-10 -7.790080735181069e-10 3.992232406849815e-09 ] [ 3.534124609147064e-09 -1.672818991276003e-09 -1.597061351502772e-09 ] [ -1.275879092602155e-09 2.941882104097951e-09 -2.285787253091785e-09 ] [ 1.984108290196166e-09 -2.32584054708815e-09 2.42092892844432e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.792605 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.408730616692918e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3184135 1.2088532 1.0530998 ] [ 0.6171051 0.0134902 2.8612053 ] [ 1.8038966 0.0407368 0.7239697 ] [ 1.6638002 2.4773844 0.8661438 ] [ 2.5993217 1.2820197 2.6742328 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.184135e-11 1.2088532e-10 1.0530998e-10 ] [ 6.171051e-11 1.34902e-12 2.8612053e-10 ] [ 1.8038966e-10 4.07368e-12 7.239697000000001e-11 ] [ 1.6638002e-10 2.4773844e-10 8.661438000000001e-11 ] [ 2.5993217e-10 1.2820197e-10 2.6742328e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 -1.53e-05 2.17e-05 ] [ -1.57e-05 1.43e-05 -1.56e-05 ] [ 7e-07 6.6e-06 -1.36e-05 ] [ -4.9e-06 -1.7e-06 -1.45e-05 ] [ 1.21e-05 -3.9e-06 2.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.233675998016e-14 -2.451330229824e-14 3.476723267136e-14 ] [ -2.515417294656e-14 2.291112567744e-14 -2.499395528448e-14 ] [ 1.12152363456e-15 1.057436569728e-14 -2.178960204288e-14 ] [ -7.850665441919999e-15 -2.72370025536e-15 -2.32315610016e-14 ] [ 1.938633711168e-14 -6.24848882112e-15 3.52478856576e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }