{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7654055 -10.8521612 1.5157974 ] [ -7.5879376 7.1540527 4.1160103 ] [ 0.1656793 -0.0848298 -0.5147228 ] [ 10.1876638 3.7829383 -5.1170849 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.430668039131734e-09 -1.738707895979287e-08 2.428575156149426e-09 ] [ -1.215721622280926e-08 1.146205597991112e-08 6.594575473631994e-09 ] [ 2.654475010105095e-10 -1.359123223071398e-10 -8.246768363527143e-10 ] [ 1.632243676093049e-08 6.060935302188897e-09 -8.198473793428706e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8124661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.108244053012555e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.966969 -0.0139113 2.649015 ] [ 0.2966569 2.1881143 3.3308916 ] [ 2.602024 2.6423109 -0.0955814 ] [ 2.4394137 1.9180478 2.0834735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.669690000000001e-11 -1.39113e-12 2.649015e-10 ] [ 2.966569e-11 2.1881143e-10 3.3308916e-10 ] [ 2.602024e-10 2.6423109e-10 -9.55814e-12 ] [ 2.4394137e-10 1.9180478e-10 2.0834735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 3.8e-06 6e-07 ] [ 7e-07 -2.3e-06 -6e-07 ] [ 1e-07 -9e-07 3.4e-06 ] [ -1.3e-06 -6e-07 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 6.08827115904e-15 9.6130597248e-16 ] [ 1.12152363456e-15 -3.68500622784e-15 -9.6130597248e-16 ] [ 1.6021766208e-16 -1.44195895872e-15 5.44740051072e-15 ] [ -2.08282960704e-15 -9.6130597248e-16 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.9703214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.597421584894192e-18 } }