{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7761559 3.3451228 7.2267151 ] [ 12.7906745 -4.877034 -5.5222345 ] [ -2.522391 0.5393008 0.4842352 ] [ -2.6588916 -1.3871897 10.4301016 ] [ -5.4053168 10.6368572 -12.7859253 ] [ 2.2629093 -2.5458796 0.0998604 ] [ -3.6908285 -5.7111775 0.0672475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.243538837075983e-09 5.359477543865034e-09 1.157847397840233e-08 ] [ 2.049291964816273e-08 -7.813869853646707e-09 -8.847595010475178e-09 ] [ -4.041315888716333e-09 8.640551333387367e-10 7.758303164084122e-10 ] [ -4.260013958761505e-09 -2.222522905954566e-09 1.671086493608867e-08 ] [ -8.660272204977469e-09 1.704212392462815e-08 -2.048531059095523e-08 ] [ 3.625580375450893e-09 -4.078948774491656e-09 1.599939982237363e-10 ] [ -5.913359134082333e-09 -9.150315067738992e-09 1.07742372307248e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4874924 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039410865089768e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9409861 0.7443572 1.7832937 ] [ 1.7193987 2.066784 3.3606576 ] [ 1.413784 4.7261174 1.2744731 ] [ 4.1252118 1.7281194 2.4861624 ] [ 3.9749341 0.2688192 4.1257165 ] [ 3.1648922 3.4032994 1.4246162 ] [ 2.9459452 3.535624 4.4457175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.409861e-11 7.443572000000001e-11 1.7832937e-10 ] [ 1.7193987e-10 2.066784e-10 3.3606576e-10 ] [ 1.413784e-10 4.7261174e-10 1.2744731e-10 ] [ 4.1252118e-10 1.7281194e-10 2.4861624e-10 ] [ 3.9749341e-10 2.688192e-11 4.125716500000001e-10 ] [ 3.164892200000001e-10 3.4032994e-10 1.4246162e-10 ] [ 2.9459452e-10 3.535624e-10 4.4457175e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0011599 0.0127646 0.0312075 ] [ -0.0326641 -0.0626219 -0.0824269 ] [ -0.0431663 0.1083329 -0.081775 ] [ -0.2121892 0.3237484 -0.1834202 ] [ 0.0819859 -0.0985488 0.043985 ] [ 0.1733697 -0.3335325 0.2212103 ] [ 0.0338241 0.0498572 0.0512195 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.85836466246592e-12 2.045114369386368e-11 4.9999926893616e-11 ] [ -5.233365735947329e-11 -1.003313441300755e-10 -1.320624521050195e-10 ] [ -6.916003666643904e-11 1.735684396434643e-10 -1.3101799316592e-10 ] [ -3.399645754262554e-10 5.187021175014067e-10 -2.938715562224602e-10 ] [ 1.313558922152467e-10 -1.57892583367895e-10 7.0471738665888e-11 ] [ 2.777688800951097e-10 -5.343779737769761e-10 3.544179709401543e-10 ] [ 5.419218223960128e-11 7.988004021854976e-11 8.20626854290656e-11 ] ] } "relaxed-potential-energy" { "source-value" -14.001882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.243348798760035e-18 } }