{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9320143 3.012582 2.150962 ] [ 2.172573 2.316103 4.293659 ] [ 2.198257 4.51425 3.345177 ] [ 3.106694 2.5483 1.973249 ] [ 3.92193 5.175884 1.747773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320143e-11 3.012582e-10 2.150962e-10 ] [ 2.172573e-10 2.316103e-10 4.293659e-10 ] [ 2.198257e-10 4.51425e-10 3.345177e-10 ] [ 3.106694e-10 2.5483e-10 1.973249e-10 ] [ 3.92193e-10 5.175884e-10 1.747773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.492414 1.2570984 -3.949126 ] [ 1.7502451 -4.1358285 7.0355351 ] [ -3.0990873 7.9226553 3.278615 ] [ 5.6161968 -5.3352772 -5.7757945 ] [ 1.2250594 0.291352 -0.5892296 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.79981730255461e-09 2.014093666525087e-09 -6.327197349793422e-09 ] [ 2.804201779889758e-09 -6.626327730338332e-09 1.127216985203779e-08 ] [ -4.965285217878196e-09 1.269349309631721e-08 5.252920301604192e-09 ] [ 8.998139210771775e-09 -8.548056395327286e-09 -9.253842914445226e-09 ] [ 1.962761529771275e-09 4.667973628233216e-10 -9.440498894033358e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4054044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.026258917644945e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7167922 3.2770843 1.6523422 ] [ 2.7734913 2.4578339 4.437128 ] [ 1.8103467 4.6854915 3.5314214 ] [ 3.1222406 2.3413558 1.8729063 ] [ 3.9085975 4.8053535 2.0170221 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.167922000000001e-11 3.2770843e-10 1.6523422e-10 ] [ 2.7734913e-10 2.4578339e-10 4.437128000000001e-10 ] [ 1.8103467e-10 4.6854915e-10 3.531421400000001e-10 ] [ 3.1222406e-10 2.3413558e-10 1.8729063e-10 ] [ 3.9085975e-10 4.8053535e-10 2.0170221e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -3.8e-06 -7.1e-06 ] [ 6.3e-06 -9.4e-06 8e-07 ] [ 1.5e-06 1.46e-05 -2e-07 ] [ -3.4e-06 -1.13e-05 2.7e-06 ] [ 6e-07 1e-05 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 -6.08827115904e-15 -1.137545400768e-14 ] [ 1.009371271104e-14 -1.506046023552e-14 1.28174129664e-15 ] [ 2.4032649312e-15 2.339177866368e-14 -3.2043532416e-16 ] [ -5.44740051072e-15 -1.810459581504e-14 4.32587687616e-15 ] [ 9.6130597248e-16 1.6021766208e-14 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }