{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.7009758 -49.1271598 3.9554523 ] [ -0.307315 9.3446014 -33.2271031 ] [ -2.7517769 41.637965 28.541664 ] [ 18.8142675 -95.2120937 25.2404077 ] [ -22.4561515 93.3566871 -24.5104209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073614685175946e-08 -7.871038752634411e-08 6.337333251961557e-09 ] [ -4.923729122777099e-10 1.497170201712369e-08 -5.323568820232897e-08 ] [ -4.408832651160953e-09 6.67113746103098e-08 4.572878715627897e-08 ] [ 3.014377977432559e-08 -1.525465918003586e-07 4.043959144957368e-08 ] [ -3.597872122286404e-08 1.495739026992692e-07 -3.927002365548525e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.5605749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.211337644438689e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3265693 -0.0154587 2.355458 ] [ -0.0751848 1.7648341 0.4509883 ] [ -0.1152139 2.4768106 3.0979322 ] [ 2.8568298 0.3298585 2.3008194 ] [ 2.0853156 2.6783302 1.6574762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.265693e-11 -1.54587e-12 2.355458e-10 ] [ -7.51848e-12 1.7648341e-10 4.509883e-11 ] [ -1.152139e-11 2.4768106e-10 3.0979322e-10 ] [ 2.8568298e-10 3.298585e-11 2.3008194e-10 ] [ 2.0853156e-10 2.6783302e-10 1.6574762e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.2e-06 -2.4e-06 -4.4e-06 ] [ -1.15e-05 2e-06 -1.33e-05 ] [ -3.7e-06 1.32e-05 8.9e-06 ] [ 1.37e-05 -1.46e-05 7.1e-06 ] [ -5.7e-06 1.8e-06 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.15356717648e-14 -3.845223921599999e-15 -7.0495771896e-15 ] [ -1.8425031291e-14 3.204353268e-15 -2.13089492322e-14 ] [ -5.9280535458e-15 2.11487315688e-14 1.42593720426e-14 ] [ 2.19498198858e-14 -2.33917788564e-14 1.13754541014e-14 ] [ -9.1324068138e-15 2.8839179412e-15 2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671621955531e-18 } }