{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1457179 -4.0349729 -0.8956164 ] [ 1.2192694 -2.6317799 0.5102114 ] [ 12.5312675 -13.9274763 -11.5208401 ] [ 7.5852377 3.2408866 17.7121559 ] [ -13.1900568 17.3533425 -5.8059108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.305087877901207e-08 -6.464739245941576e-09 -1.434935657285061e-09 ] [ 1.953484927136844e-09 -4.216576226871362e-09 8.174487767456371e-10 ] [ 2.007730381749087e-08 -2.231427691460609e-08 -1.845842066019513e-08 ] [ 1.215289050615077e-08 5.192472741184001e-09 2.837800208694478e-08 ] [ -2.113280063198406e-08 2.780311964623502e-08 -9.302094546210226e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4826098 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.519281572572897e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.606627 0.1218051 1.3017287 ] [ 0.2946554 2.2613986 2.2347714 ] [ 2.7421394 0.2117747 0.3131734 ] [ 2.4853923 1.4025449 2.328587 ] [ 1.4631746 2.1854041 0.1916036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.066270000000001e-11 1.218051e-11 1.3017287e-10 ] [ 2.946554e-11 2.2613986e-10 2.2347714e-10 ] [ 2.7421394e-10 2.117747e-11 3.131734e-11 ] [ 2.4853923e-10 1.4025449e-10 2.328587e-10 ] [ 1.4631746e-10 2.1854041e-10 1.916036e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 4.6e-06 4.5e-06 ] [ -9.2e-06 4.6e-06 1.77e-05 ] [ 2.93e-05 -3.08e-05 -2.29e-05 ] [ -1.19e-05 9.7e-06 7.4e-06 ] [ -3.2e-06 1.19e-05 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 7.370012455680001e-15 7.2097947936e-15 ] [ -1.474002491136e-14 7.370012455680001e-15 2.835852618816e-14 ] [ 4.694377498944e-14 -4.934703992064001e-14 -3.668984461632e-14 ] [ -1.906590178752e-14 1.554111322176e-14 1.185610699392e-14 ] [ -5.126965186560001e-15 1.906590178752e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }