{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6943013 -3.8275548 -10.1875666 ] [ -6.7544951 -3.7852245 7.6117923 ] [ -5.414905 10.1894151 -2.8912059 ] [ 6.1272429 -1.5334788 -1.9013402 ] [ 5.1043947 -5.5420779 2.2017805 ] [ 1.8229324 1.2457861 -1.6647694 ] [ 4.8091314 3.2531347 6.8313093 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.123276489815824e-09 -6.132418865914542e-09 -1.632228116383882e-08 ] [ -1.082189422368749e-08 -6.064598248344332e-09 1.219543576592112e-08 ] [ -8.67563426632977e-09 1.632524278734677e-08 -4.63222253706294e-09 ] [ 9.816925405222397e-09 -2.456903902094359e-09 -3.046282841724886e-09 ] [ 8.17814191905344e-09 -8.879387715187788e-09 3.527641270296836e-09 ] [ 2.920659696641541e-09 1.995969380381987e-09 -2.667254633678199e-09 ] [ 7.705077958915708e-09 5.212096403594599e-09 1.09449641400869e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.845707 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.417238506661024e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4720631 2.228094 1.7507672 ] [ 1.6890635 2.6938233 4.7086337 ] [ 2.4301055 4.4441915 2.9293052 ] [ 4.9797429 2.4035438 1.6188867 ] [ 3.8948998 1.6491617 3.8074147 ] [ 4.4698925 4.7382939 1.660874 ] [ 3.8976017 3.9308557 5.0072665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4720631e-10 2.228094e-10 1.7507672e-10 ] [ 1.6890635e-10 2.6938233e-10 4.7086337e-10 ] [ 2.4301055e-10 4.4441915e-10 2.9293052e-10 ] [ 4.9797429e-10 2.4035438e-10 1.6188867e-10 ] [ 3.8948998e-10 1.6491617e-10 3.8074147e-10 ] [ 4.4698925e-10 4.738293900000001e-10 1.660874e-10 ] [ 3.8976017e-10 3.9308557e-10 5.007266500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 8.5e-06 -5.6e-06 ] [ -4e-07 -2.6e-06 1.9e-06 ] [ -6.1e-06 9.5e-06 5e-06 ] [ 1.38e-05 -2.2e-06 9.6e-06 ] [ -6.9e-06 -2.2e-06 -8.9e-06 ] [ -1.5e-05 -1.44e-05 -4.8e-06 ] [ 8.3e-06 3.4e-06 2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.00937127942e-14 1.3618501389e-14 -8.972189150399999e-15 ] [ -6.408706536e-16 -4.165659248399999e-15 3.0441356046e-15 ] [ -9.773277467399999e-15 1.5220678023e-14 8.010883169999999e-15 ] [ 2.21100375492e-14 -3.5247885948e-15 1.53808956864e-14 ] [ -1.10550187746e-14 -3.5247885948e-15 -1.42593720426e-14 ] [ -2.403264951e-14 -2.30713435296e-14 -7.690447843199998e-15 ] [ 1.32980660622e-14 5.4474005556e-15 4.6463122386e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.403979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.628207185842668e-18 } }