{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0951882 -1.0654582 -0.3527077 ] [ -0.611552 -1.3017479 -0.829786 ] [ 0.331552 0.5502173 -0.3771247 ] [ -0.1263554 -0.2630171 0.9675354 ] [ -0.4523663 -0.468808 0.0076763 ] [ -0.1100084 0.7782581 -0.237703 ] [ 1.0639183 1.7705559 0.8221097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.525083098725188e-10 -1.707052232543698e-09 -5.651000355718818e-10 ] [ -9.798143248759679e-10 -2.085630068738569e-09 -1.329463740420324e-09 ] [ 5.31204867355968e-10 8.815453016825682e-10 -6.042203824442597e-10 ] [ -2.024436694597236e-10 -4.213998519624414e-10 1.550162610447844e-09 ] [ -7.247707158690341e-10 -7.511132234322719e-10 1.22987884955742e-11 ] [ -1.762528880237256e-10 1.246906943041235e-09 -3.80842192431702e-10 ] [ 1.704585040745002e-09 2.83674329217084e-09 1.31716495192475e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.121157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.621588125444554e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3815831 2.2751863 0.3914823 ] [ 4.2426662 1.2946321 4.2819714 ] [ 1.6342526 5.2813923 2.5705273 ] [ 1.2947025 4.1915559 4.5617038 ] [ 3.9788905 0.8099874 2.0540992 ] [ 2.5616404 4.4014727 0.664343 ] [ 4.2751897 3.3805262 5.238949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3815831e-10 2.2751863e-10 3.914823e-11 ] [ 4.242666200000001e-10 1.2946321e-10 4.2819714e-10 ] [ 1.6342526e-10 5.281392300000001e-10 2.5705273e-10 ] [ 1.2947025e-10 4.1915559e-10 4.5617038e-10 ] [ 3.9788905e-10 8.099874e-11 2.0540992e-10 ] [ 2.5616404e-10 4.401472700000001e-10 6.64343e-11 ] [ 4.275189700000001e-10 3.3805262e-10 5.238949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.34e-05 -1.12e-05 1.04e-05 ] [ -1.24e-05 -7.5e-06 8.4e-06 ] [ -8.6e-06 -7.9e-06 3.2e-05 ] [ -2.4e-06 1.32e-05 -4.9e-06 ] [ -2.2e-06 -5.3e-06 -1.88e-05 ] [ 9.5e-06 -2e-06 2.33e-05 ] [ -7.3e-06 2.08e-05 -5.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.749093323559999e-14 -1.79443783008e-14 1.66626369936e-14 ] [ -1.98669902616e-14 -1.2016324755e-14 1.34582837256e-14 ] [ -1.37787190524e-14 -1.26571954086e-14 5.126965228799999e-14 ] [ -3.845223921599999e-15 2.11487315688e-14 -7.850665506599998e-15 ] [ -3.5247885948e-15 -8.4915361602e-15 -3.012092071919999e-14 ] [ 1.5220678023e-14 -3.204353268e-15 3.733071557219999e-14 ] [ -1.16958894282e-14 3.332527398719999e-14 -8.074970235359998e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.995529 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.562766281226938e-18 } }