{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3329245 -2.6951771 -6.8422571 ] [ 0.7797318 -0.1153479 -0.5269475 ] [ -2.2502827 -0.7239369 3.9695753 ] [ -0.8303063 -4.729158 -3.1241996 ] [ 2.7224816 3.2709972 3.2757894 ] [ -0.2300685 -0.0007415 -1.0519226 ] [ 6.1413686 4.9933642 4.299962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.014646365878613e-08 -4.318149774111881e-09 -1.09625044494406e-08 ] [ 1.249268070746761e-09 -1.848077101609686e-10 -8.44262971844715e-10 ] [ -3.605350361834432e-09 -1.159874785670394e-09 6.35996079256354e-09 ] [ -1.330297352922994e-09 -7.576946446094172e-09 -5.005519599072146e-09 ] [ 4.361896406014934e-09 5.240715283719424e-09 5.248393234584879e-09 ] [ -3.68610374919429e-10 -1.188013974111e-12 -1.685365810496528e-09 ] [ 9.839557271701291e-09 8.000251446292102e-09 6.889298643487907e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.056255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.091842668854567e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0769215 3.278759 1.7759949 ] [ 2.2854352 0.8478801 2.4117938 ] [ 2.676392 2.6055224 4.2306141 ] [ 4.5357678 0.1501253 2.6871609 ] [ 5.1605526 2.0541655 3.9563971 ] [ 3.7552227 4.6866676 0.5972291 ] [ 4.3105022 4.2158919 2.9759689 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0769215e-10 3.278759e-10 1.7759949e-10 ] [ 2.2854352e-10 8.478801e-11 2.4117938e-10 ] [ 2.676392e-10 2.6055224e-10 4.230614100000001e-10 ] [ 4.5357678e-10 1.501253e-11 2.6871609e-10 ] [ 5.160552600000001e-10 2.0541655e-10 3.9563971e-10 ] [ 3.7552227e-10 4.6866676e-10 5.972291e-11 ] [ 4.3105022e-10 4.2158919e-10 2.9759689e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 9.5e-06 1.9e-06 ] [ 1e-05 2.17e-05 2.9e-06 ] [ -1.86e-05 -9.8e-06 -1.81e-05 ] [ 2.7e-06 -6.5e-06 3.5e-06 ] [ 8.9e-06 -4.2e-06 2.8e-06 ] [ -1.69e-05 -1.73e-05 1.21e-05 ] [ 1.11e-05 6.6e-06 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.6463122386e-15 1.5220678023e-14 3.0441356046e-15 ] [ 1.602176634e-14 3.476723295779999e-14 4.6463122386e-15 ] [ -2.98004853924e-14 -1.57013310132e-14 -2.899939707539999e-14 ] [ 4.3258769118e-15 -1.0414148121e-14 5.607618218999999e-15 ] [ 1.42593720426e-14 -6.729141862799999e-15 4.486094575199999e-15 ] [ -2.70767851146e-14 -2.77176557682e-14 1.93863372714e-14 ] [ 1.77841606374e-14 1.05743657844e-14 -8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.889003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.70591659781559e-18 } }