{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4184945 4.1550404 12.0009932 ] [ 8.6334145 -5.2345446 -1.4862948 ] [ 1.1356923 2.7308696 -0.0669098 ] [ -6.5757454 -1.6604116 -10.0318425 ] [ 1.6081189 -1.8765986 0.8860225 ] [ 0.7638382 6.090851 0.5940092 ] [ -5.9838132 -4.2052062 -1.8959778 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.705021038333857e-10 6.65710858735948e-09 1.922771073141978e-08 ] [ 1.383225486957572e-08 -8.386664978654889e-09 -2.381306780176612e-09 ] [ 1.81957965148258e-09 4.375335427573447e-09 -1.072013172624038e-10 ] [ -1.053550554421314e-08 -2.660272646425121e-09 -1.607278351704783e-08 ] [ 2.576490505046613e-09 -3.006642403546011e-09 1.419564535002768e-09 ] [ 1.223803706113955e-09 9.758619072976301e-09 9.517076527801113e-10 ] [ -9.587125612274436e-09 -6.737483059283209e-09 -3.037691304715818e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.881635 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.345606740107901e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5887255 1.6899477 1.4501222 ] [ 2.3914407 4.0751974 1.8631261 ] [ 4.7849915 3.145211 1.350924 ] [ 4.6983494 0.8657534 2.3556494 ] [ 4.6472329 1.0199026 4.7748658 ] [ 5.7448867 2.8557188 3.632976 ] [ 4.1749572 4.7061731 3.3862292 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5887255e-10 1.6899477e-10 1.4501222e-10 ] [ 2.3914407e-10 4.0751974e-10 1.8631261e-10 ] [ 4.784991500000001e-10 3.145211000000001e-10 1.350924e-10 ] [ 4.6983494e-10 8.657534e-11 2.3556494e-10 ] [ 4.6472329e-10 1.0199026e-10 4.7748658e-10 ] [ 5.7448867e-10 2.8557188e-10 3.632976e-10 ] [ 4.1749572e-10 4.7061731e-10 3.3862292e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.48e-05 -2.49e-05 2.94e-05 ] [ -4.44e-05 1.43e-05 1.71e-05 ] [ 1.85e-05 3.55e-05 1.3e-06 ] [ 2.87e-05 -7.99e-05 1.02e-05 ] [ -6.63e-05 5.26e-05 -3.84e-05 ] [ 2.31e-05 -4.01e-05 -5.33e-05 ] [ -4.4e-06 4.24e-05 3.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.177751261183999e-14 -3.989419785791999e-14 4.710399265152e-14 ] [ -7.113664196352e-14 2.291112567744e-14 2.739722021568e-14 ] [ 2.96402674848e-14 5.68772700384e-14 2.08282960704e-15 ] [ 4.598246901696e-14 -1.2801391200192e-13 1.634220153216e-14 ] [ -1.0622430995904e-13 8.427449025408001e-14 -6.152358223872e-14 ] [ 3.701027994048e-14 -6.424728249408e-14 -8.539601388864e-14 ] [ -7.04957713152e-15 6.793228872192001e-14 5.399335212096e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.900176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.989447984100526e-18 } }