{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.426259 1.696941 2.248909 ] [ 1.360678 2.530518 4.32015 ] [ 2.124458 3.992448 3.096339 ] [ 3.479806 2.793816 1.249034 ] [ 3.515691 1.341825 3.018021 ] [ 4.217135 3.723991 3.061085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.426259e-10 1.696941e-10 2.248909e-10 ] [ 1.360678e-10 2.530518e-10 4.32015e-10 ] [ 2.124458e-10 3.992448e-10 3.096339e-10 ] [ 3.479806e-10 2.793816e-10 1.249034e-10 ] [ 3.515691e-10 1.341825e-10 3.018021e-10 ] [ 4.217135e-10 3.723991e-10 3.061085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1575267 -0.6647678 -3.0847167 ] [ -1.5094908 -4.3799224 5.5028804 ] [ -2.6908911 6.2324301 -3.843494 ] [ -1.5116135 -0.4542157 -4.8114553 ] [ 1.761732 -1.4300521 2.9382306 ] [ 6.1077902 0.696528 3.298555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.456738837491775e-09 -1.06507542742065e-09 -4.942260978531327e-09 ] [ -2.418470869072689e-09 -7.017409270198226e-09 8.816586323938552e-09 ] [ -4.311282809538795e-09 9.985453796990206e-09 -6.157956228985076e-09 ] [ -2.42187180938566e-09 -7.277337753403065e-10 -7.708801193684252e-09 ] [ 2.822605822515225e-09 -2.291196041145944e-09 4.707564373839157e-09 ] [ 9.785758663191358e-09 1.115960877332583e-09 5.284867703422944e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.363756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.301327405007573e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3016217 1.7921413 2.0516107 ] [ 1.4958427 2.2724133 4.4465011 ] [ 2.0355309 4.0801021 2.892814 ] [ 3.364446 2.7916324 1.1450141 ] [ 3.4916474 1.4467656 3.3028177 ] [ 4.4349384 3.6964843 3.1547803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3016217e-10 1.7921413e-10 2.0516107e-10 ] [ 1.4958427e-10 2.2724133e-10 4.4465011e-10 ] [ 2.0355309e-10 4.080102100000001e-10 2.892814e-10 ] [ 3.364446e-10 2.7916324e-10 1.1450141e-10 ] [ 3.4916474e-10 1.4467656e-10 3.3028177e-10 ] [ 4.4349384e-10 3.6964843e-10 3.1547803e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 2.7e-06 2.55e-05 ] [ 9.4e-06 9.9e-06 5.8e-06 ] [ -9.2e-06 -2.1e-05 2.5e-06 ] [ 1.91e-05 7.1e-06 -6.89e-05 ] [ -2.12e-05 -6e-07 2.5e-06 ] [ -2.2e-06 1.9e-06 3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924145279999e-15 4.32587687616e-15 4.08555038304e-14 ] [ 1.506046023552e-14 1.586154854592e-14 9.292624400640001e-15 ] [ -1.474002491136e-14 -3.36457090368e-14 4.005441552e-15 ] [ 3.060157345728e-14 1.137545400768e-14 -1.1038996917312e-13 ] [ -3.396614436096001e-14 -9.6130597248e-16 4.005441552e-15 ] [ -3.52478856576e-15 3.04413557952e-15 5.223095783807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.587451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.817820281166558e-18 } }