{ "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" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9874084 0.2080977 3.0540392 ] [ -0.8116928 -2.4437813 -0.1366314 ] [ 2.8926205 1.5983703 0.6085115 ] [ -0.6285981 -0.0501243 -2.7045784 ] [ -0.4649213 0.6874376 -0.8213408 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.582002653661535e-09 3.334092697822521e-10 4.893110205246735e-09 ] [ -1.30047522743169e-09 -3.915369265208231e-09 -2.189076347471731e-10 ] [ 4.634488937946807e-09 2.560871526041082e-09 9.749428987879391e-10 ] [ -1.007125179699301e-09 -8.030798159396544e-11 -4.333212281600671e-09 ] [ -7.44886037371943e-10 1.101396450978862e-09 -1.315933027469169e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.213182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.116985128677539e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2005669 2.3302624 2.4583671 ] [ 3.6999947 0.8085755 1.1706888 ] [ 4.5986624 3.0606107 1.7560794 ] [ 3.684186 3.5949668 4.0144308 ] [ 4.277048 1.2144528 3.5632179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2005669e-10 2.3302624e-10 2.4583671e-10 ] [ 3.6999947e-10 8.085755e-11 1.1706888e-10 ] [ 4.5986624e-10 3.0606107e-10 1.7560794e-10 ] [ 3.684186e-10 3.5949668e-10 4.0144308e-10 ] [ 4.277048e-10 1.2144528e-10 3.5632179e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.71e-05 4e-07 1.08e-05 ] [ 6.2e-06 3.09e-05 4.5e-06 ] [ -2.37e-05 -1.83e-05 2.82e-05 ] [ 4.9e-06 -1.53e-05 -4.64e-05 ] [ -4.4e-06 2.3e-06 2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.739722021568e-14 6.408706483200001e-16 1.730350750464e-14 ] [ 9.93349504896e-15 4.950725758272e-14 7.2097947936e-15 ] [ -3.797158591296e-14 -2.931983216064e-14 4.518138070656001e-14 ] [ 7.850665441919999e-15 -2.451330229824e-14 -7.434099520512001e-14 ] [ -7.04957713152e-15 3.68500622784e-15 4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }