{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4219334 -3.3438673 -0.8539416 ] [ -4.6672793 1.3636829 3.6399748 ] [ 1.4156706 4.1110068 1.5838787 ] [ 0.450716 2.8310578 -7.7156344 ] [ 6.2228261 -4.9618803 3.3457224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.482541691414655e-09 -5.357466011117619e-09 -1.368165267048545e-09 ] [ -7.47780577720379e-09 2.184860860564744e-09 5.831882524861156e-09 ] [ 2.268154338073908e-09 6.586558982909822e-09 2.537653423323097e-09 ] [ 7.221266378204929e-10 4.535854619293482e-09 -1.236180905032023e-08 ] [ 9.970066492724044e-09 -7.94980861186809e-09 5.360438208966867e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1613983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.065118445296866e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5996539 2.5848273 1.4480891 ] [ 1.9581092 4.3987936 3.057822 ] [ 4.2372478 5.2469323 2.4418027 ] [ 3.4930781 4.5388321 0.1531119 ] [ 4.8042159 2.8099827 2.6239105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5996539e-10 2.5848273e-10 1.4480891e-10 ] [ 1.9581092e-10 4.3987936e-10 3.057822e-10 ] [ 4.2372478e-10 5.2469323e-10 2.4418027e-10 ] [ 3.4930781e-10 4.5388321e-10 1.531119e-11 ] [ 4.8042159e-10 2.8099827e-10 2.6239105e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.72e-05 3.69e-05 1.85e-05 ] [ 3.81e-05 -1.2e-06 -6.16e-05 ] [ -1.55e-05 -4.67e-05 -1.09e-05 ] [ -4.23e-05 5.5e-06 4.6e-05 ] [ -1.75e-05 5.5e-06 7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.960097029376001e-14 5.912031730752001e-14 2.96402674848e-14 ] [ 6.104292925248e-14 -1.92261194496e-15 -9.869407984128002e-14 ] [ -2.48337376224e-14 -7.482164819136e-14 -1.746372516672e-14 ] [ -6.777207105984e-14 8.8119714144e-15 7.37001245568e-14 ] [ -2.8038090864e-14 8.8119714144e-15 1.265719530432e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }