{ "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" [ [ -3.7232741 -2.9455917 -5.0410886 ] [ -2.4585068 -1.8926823 3.5177449 ] [ -4.5422487 8.6623458 -2.6217694 ] [ 3.2663877 0.197215 -0.4222634 ] [ 3.8632407 -5.6719632 1.9922788 ] [ 1.1621656 0.521017 -1.0127151 ] [ 2.4322356 1.1296593 3.5878127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.965342715850161e-09 -4.719358156162528e-09 -8.076714298301403e-09 ] [ -3.938962117037821e-09 -3.032411331661972e-09 5.636048636718434e-09 ] [ -7.277484672999193e-09 1.387860792204507e-08 -4.200537637808843e-09 ] [ 5.233330007408684e-09 3.15973262271072e-10 -6.765405472995187e-10 ] [ 6.189593930063026e-09 -9.087486833077955e-09 3.191982515475479e-09 ] [ 1.861994553818005e-09 8.347612564393535e-10 -1.622548456751134e-09 ] [ 3.89687101459746e-09 1.809913719929293e-09 5.748309627749324e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.479044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.800451565073452e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5395409 2.2195412 1.7764088 ] [ 1.812891 2.7894994 4.7023556 ] [ 2.4301502 4.3290874 2.8858082 ] [ 4.8810153 2.5317881 1.8457045 ] [ 3.7557585 1.5723303 3.7986067 ] [ 4.4447387 4.8279322 1.7397793 ] [ 3.9692744 3.8177854 4.734485 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5395409e-10 2.2195412e-10 1.7764088e-10 ] [ 1.812891e-10 2.7894994e-10 4.7023556e-10 ] [ 2.4301502e-10 4.3290874e-10 2.8858082e-10 ] [ 4.8810153e-10 2.5317881e-10 1.8457045e-10 ] [ 3.7557585e-10 1.5723303e-10 3.7986067e-10 ] [ 4.4447387e-10 4.8279322e-10 1.7397793e-10 ] [ 3.9692744e-10 3.8177854e-10 4.734485000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 -5.8e-06 8.3e-06 ] [ 3.6e-06 6.3e-06 -8e-06 ] [ 8.8e-06 -1.59e-05 -7e-07 ] [ -1.16e-05 -1.5e-06 -1e-06 ] [ -7.1e-06 1.62e-05 -9.8e-06 ] [ -2.3e-06 5.6e-06 9e-07 ] [ 1e-06 -4.9e-06 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.233675998016e-14 -9.292624400640001e-15 1.329806595264e-14 ] [ 5.76783583488e-15 1.009371271104e-14 -1.28174129664e-14 ] [ 1.409915426304e-14 -2.547460827072e-14 -1.12152363456e-15 ] [ -1.858524880128e-14 -2.4032649312e-15 -1.6021766208e-15 ] [ -1.137545400768e-14 2.595526125696e-14 -1.570133088384e-14 ] [ -3.68500622784e-15 8.972189076479999e-15 1.44195895872e-15 ] [ 1.6021766208e-15 -7.850665441919999e-15 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.130859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.385536826722127e-18 } }