{ "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" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 15.3721021 -14.0811191 11.8538154 ] [ -48.7048987 -87.6313805 -87.6939767 ] [ 35.2798847 101.7260793 73.1129011 ] [ 8.0204284 -21.4280428 0.4167013 ] [ -17.0626777 12.3330926 -12.9596348 ] [ 7.0951612 9.0813706 15.2701939 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.462882259717058e-08 -2.256043981672034e-08 1.8991905901159e-08 ] [ -7.803385001557232e-08 -1.40400949085529e-07 -1.405012392537199e-07 ] [ 5.652460645085962e-08 1.629831459801068e-07 1.171397808212826e-07 ] [ 1.285014287128035e-08 -3.433150920366177e-08 6.676290807169671e-10 ] [ -2.733742329918551e-08 1.975979262588149e-08 -2.076362389066608e-08 ] [ 1.136770139544727e-08 1.454995966014047e-08 2.446554766166277e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.444151 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.236820048910495e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8502697 0.6931684 2.7653959 ] [ 0.2242586 1.0648648 1.0517194 ] [ 0.6094949 2.6562198 2.6954132 ] [ 2.365504 0.3272522 0.5330885 ] [ 1.7677656 2.4973481 0.0498061 ] [ 2.8365016 2.7033602 2.1136988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8502697e-10 6.931684000000001e-11 2.7653959e-10 ] [ 2.242586e-11 1.0648648e-10 1.0517194e-10 ] [ 6.094949e-11 2.6562198e-10 2.6954132e-10 ] [ 2.365504e-10 3.272522e-11 5.330885e-11 ] [ 1.7677656e-10 2.4973481e-10 4.98061e-12 ] [ 2.8365016e-10 2.7033602e-10 2.1136988e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.8e-06 -1.67e-05 -1.72e-05 ] [ -4e-07 7.3e-06 -1.49e-05 ] [ 1.37e-05 1.46e-05 6.2e-06 ] [ 9.9e-06 -4.27e-05 -1.19e-05 ] [ -1.85e-05 -1.22e-05 2.09e-05 ] [ 4.2e-06 4.97e-05 1.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.409915426304e-14 -2.675634956736e-14 -2.755743787776e-14 ] [ -6.408706483200001e-16 1.169588933184e-14 -2.387243164992e-14 ] [ 2.194981970496e-14 2.339177866368e-14 9.93349504896e-15 ] [ 1.586154854592e-14 -6.841294170816001e-14 -1.906590178752e-14 ] [ -2.96402674848e-14 -1.954655477376e-14 3.348549137472e-14 ] [ 6.72914180736e-15 7.962817805376001e-14 2.691656722944e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.007871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.166920287298232e-18 } }