{ "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" [ [ 1.568329 2.374036 2.84115 ] [ 2.585215 4.223663 1.237778 ] [ 4.050363 2.582934 1.712612 ] [ 3.258528 3.911947 3.864299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.568329e-10 2.374036e-10 2.84115e-10 ] [ 2.585215e-10 4.223663e-10 1.237778e-10 ] [ 4.050363e-10 2.582934e-10 1.712612e-10 ] [ 3.258528e-10 3.911947e-10 3.864299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9683399 0.8390505 -0.1960656 ] [ -0.6622082 0.1533062 0.4753317 ] [ 0.0639219 -0.3273526 0.7573102 ] [ -0.3700537 -0.665004 -1.0365763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.55145154876781e-09 1.344307094770551e-09 -3.141317204631245e-10 ] [ -1.060974496142051e-09 2.456236094636889e-10 7.615653368651194e-10 ] [ 1.024141737371155e-10 -5.244766824780941e-10 1.213344697133372e-09 ] [ -5.928913865805369e-10 -1.065453861538483e-09 -1.660778313535367e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4208183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.685108345864801e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3561666 3.2190647 2.9474916 ] [ 2.3299322 3.4998458 0.9214286 ] [ 4.3750515 3.3272365 1.8804298 ] [ 3.4012846 3.0464329 3.906489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3561666e-10 3.2190647e-10 2.9474916e-10 ] [ 2.3299322e-10 3.4998458e-10 9.214286000000001e-11 ] [ 4.3750515e-10 3.3272365e-10 1.8804298e-10 ] [ 3.4012846e-10 3.0464329e-10 3.906489e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 -3.5e-06 -6e-06 ] [ 3.3e-06 3.7e-06 4.5e-06 ] [ -9.7e-06 -4.3e-06 3e-07 ] [ 4.2e-06 4.1e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 -5.6076181728e-15 -9.6130597248e-15 ] [ 5.28718284864e-15 5.928053496960001e-15 7.2097947936e-15 ] [ -1.554111322176e-14 -6.889359469440001e-15 4.8065298624e-16 ] [ 6.72914180736e-15 6.568924145279999e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }