{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.242935700000001e-10 2.0627858e-10 3.0165389e-10 ] [ 1.9572754e-10 8.312191e-11 3.9086231e-10 ] [ 5.4912128e-10 7.1296911e-10 1.7882412e-10 ] [ 2.4625752e-10 3.420611e-10 -9.173142e-11 ] ] "source-value" [ [ 7.2429357 2.0627858 3.0165389 ] [ 1.9572754 0.8312191 3.9086231 ] [ 5.4912128 7.1296911 1.7882412 ] [ 2.4625752 3.420611 -0.9173142 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -3.2043532416e-16 6.408706483200001e-16 ] [ 3.2043532416e-16 4.8065298624e-16 3.2043532416e-16 ] [ -3.2043532416e-16 -1.6021766208e-16 -9.6130597248e-16 ] ] "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 -2e-07 4e-07 ] [ 2e-07 3e-07 2e-07 ] [ -2e-07 -1e-07 -6e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.181158370443016e-31 "source-value" 1.9855229e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.431984728047429e-09 -1.259113115353793e-09 1.457060915329999e-09 ] [ -2.419290702849552e-09 -2.942697451780276e-09 2.290092301671875e-09 ] [ 1.188177706773846e-09 3.498736853470468e-09 -2.392902052816665e-10 ] [ -2.200871731971723e-09 7.030737136636013e-10 -3.507863011720206e-09 ] ] "source-value" [ [ 2.1420764 -0.7858766 0.9094259 ] [ -1.5100025 -1.8366873 1.4293632 ] [ 0.7416022 2.1837398 -0.1493532 ] [ -1.3736761 0.4388241 -2.1894359 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.618652282512565e-19 "source-value" 6.0034906 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] "source-value" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] } "instance-id" 1 }