{ "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" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6481997 3.3810675 -0.7872698 ] [ -5.6300571 -2.0349915 -2.3047214 ] [ 3.5195583 2.3552196 -2.0445971 ] [ 0.4622991 -3.7012957 5.1365883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.640707025749574e-09 5.417067301846704e-09 -1.261345267821892e-09 ] [ -9.020345859389048e-09 -3.260415804826723e-09 -3.692570744537445e-09 ] [ 5.638954023802593e-09 3.773477779969928e-09 -3.275805672575479e-09 ] [ 7.406848098368813e-10 -5.930129437207571e-09 8.229721684934816e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4585267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.515423034595258e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6899014 2.2060448 2.7823618 ] [ 1.9015566 3.7547674 1.0961098 ] [ 3.9261085 4.6795892 1.6728946 ] [ 3.6930235 3.1617096 3.3847178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6899014e-10 2.2060448e-10 2.7823618e-10 ] [ 1.9015566e-10 3.7547674e-10 1.0961098e-10 ] [ 3.9261085e-10 4.6795892e-10 1.6728946e-10 ] [ 3.6930235e-10 3.1617096e-10 3.3847178e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0025447 -0.0014892 0.0074525 ] [ -0.013979 0.0024052 -0.022818 ] [ 0.0038428 0.0055784 0.0042808 ] [ 0.0126809 -0.0064944 0.0110847 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.07705884694976e-12 -2.38596142369536e-12 1.1940221266512e-11 ] [ -2.23968269821632e-11 3.85355520834816e-12 -3.65584661334144e-11 ] [ 6.15684431841024e-12 8.93758206147072e-12 6.858597678320641e-12 ] [ 2.031704151070272e-11 -1.040517584612352e-11 1.775964718858176e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.60189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.858827691509331e-18 } }