{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5159716 0.3645492 -0.0701535 ] [ -2.1878858 -1.8809715 2.8870047 ] [ -0.9295389 -0.8450432 -0.4950906 ] [ -0.2806416 -1.8812543 -4.274952 ] [ 4.6068713 -3.9352973 2.6674801 ] [ -0.6928334 8.1780171 -0.7142887 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.266776345167692e-10 5.840722053713433e-10 -1.123982975672928e-10 ] [ -3.505379477740305e-09 -3.013648561691107e-09 4.625491434479717e-09 ] [ -1.489285493704149e-09 -1.353908458606019e-09 -7.932225844978445e-10 ] [ -4.496374103439053e-10 -3.014101657239469e-09 -6.849228149442201e-09 ] [ 7.381021491894503e-09 -6.305041329957364e-09 4.273774252669246e-09 ] [ -1.110041475589375e-09 1.310262780212262e-08 -1.144416655641625e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.860101 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.06041531633267e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.003679 1.1876236 3.1776356 ] [ 3.1747247 2.0286546 5.1010481 ] [ 2.3191968 3.4085295 2.0144284 ] [ 4.0528789 1.5886785 1.7546299 ] [ 5.223931 2.4296938 3.6780465 ] [ 3.4902566 4.249555 3.9378345 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.003679e-10 1.1876236e-10 3.1776356e-10 ] [ 3.1747247e-10 2.0286546e-10 5.1010481e-10 ] [ 2.3191968e-10 3.4085295e-10 2.0144284e-10 ] [ 4.0528789e-10 1.5886785e-10 1.7546299e-10 ] [ 5.223931e-10 2.4296938e-10 3.6780465e-10 ] [ 3.4902566e-10 4.249555e-10 3.9378345e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 1.14e-05 3e-07 ] [ 3.6e-06 4.1e-06 -1.06e-05 ] [ 1.6e-06 -3.7e-06 3.4e-06 ] [ 4.3e-06 -3.9e-06 6.7e-06 ] [ -1.8e-06 2.3e-06 -5.2e-06 ] [ -5.9e-06 -1.02e-05 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 1.826481347712e-14 4.8065298624e-16 ] [ 5.76783583488e-15 6.568924145279999e-15 -1.698307218048e-14 ] [ 2.56348259328e-15 -5.928053496960001e-15 5.44740051072e-15 ] [ 6.889359469440001e-15 -6.24848882112e-15 1.073458335936e-14 ] [ -2.88391791744e-15 3.68500622784e-15 -8.33131842816e-15 ] [ -9.45284206272e-15 -1.634220153216e-14 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.807034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.532566031899071e-18 } }