{ "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" [ [ 0.349925 1.341612 0.6560134 ] [ 0.6162161 0.8811692 2.732129 ] [ 2.287058 0.0970069 0.7690432 ] [ 2.096073 0.9342159 2.106012 ] [ 2.754629 2.399765 1.157711 ] [ 1.653705 1.889806 0.0543731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.49925e-11 1.341612e-10 6.560134e-11 ] [ 6.162161e-11 8.811692000000001e-11 2.732129e-10 ] [ 2.287058e-10 9.70069e-12 7.690432000000001e-11 ] [ 2.096073e-10 9.342159e-11 2.106012e-10 ] [ 2.754629e-10 2.399765e-10 1.157711e-10 ] [ 1.653705e-10 1.889806e-10 5.43731e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.4010674 -12.7463645 11.2813248 ] [ -24.2437383 -1.217615 5.4634781 ] [ -5.5628965 -8.800686 3.8184943 ] [ 11.6811178 -12.1458498 -1.3931179 ] [ 41.795134 32.0006166 20.3533399 ] [ -28.0706843 2.9098986 -39.5235191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.051287352939131e-09 -2.042192737034709e-08 1.807467499512472e-08 ] [ -3.884275102507088e-08 -1.95083430220791e-09 8.753456952190713e-09 ] [ -8.91274278966038e-09 -1.410025347237092e-08 6.117902344522185e-09 ] [ 1.871521399816149e-08 -1.945979674963357e-08 -2.232020947787149e-09 ] [ 6.696318710969895e-08 5.127064019011252e-08 3.260964561163989e-08 ] [ -4.497419448585065e-08 4.662171544229313e-09 -6.332365879547271e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.19569694435738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.036795692159459e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4761866 1.1433461 0.560622 ] [ 0.4091669 0.527229 2.7892627 ] [ 1.9299076 0.3937504 1.2535978 ] [ 2.2517949 1.1317232 1.8815572 ] [ 3.2405059 2.3307957 1.080427 ] [ 1.4500443 2.0167306 -0.0901849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.761866e-11 1.1433461e-10 5.60622e-11 ] [ 4.091669e-11 5.272289999999999e-11 2.7892627e-10 ] [ 1.9299076e-10 3.937504e-11 1.2535978e-10 ] [ 2.2517949e-10 1.1317232e-10 1.8815572e-10 ] [ 3.2405059e-10 2.3307957e-10 1.080427e-10 ] [ 1.4500443e-10 2.0167306e-10 -9.01849e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 481.4188184 -591.8129586 233.4241088 ] [ 81.0482526 -56.0077438 -26.0416738 ] [ -42.9319025 2453.0482721 1135.428065 ] [ -790.6063716 -1894.3025352 -1197.7424506 ] [ 99.4728149 -18.7563167 -188.6540346 ] [ 171.5983882 107.8312823 43.5859852 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.713179820083693e-07 -9.481888939673292e-07 3.739866529316338e-07 ] [ 1.298536165422497e-07 -8.973429843941836e-08 -4.172336127260999e-08 ] [ -6.878449103866618e-08 3.930216623632694e-06 1.819156315330833e-06 ] [ -1.266691055269041e-06 -3.035007259624403e-06 -1.918994967901219e-06 ] [ 1.59373019750987e-07 -3.005093235664398e-08 -3.022570861459475e-07 ] [ 2.749309280061012e-07 1.727647609153178e-07 6.983244705730982e-08 ] ] } "relaxed-potential-energy" { "source-value" -2534.4507540556424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.060637778171631e-16 } }