{ "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" [ [ -8.799817375054475e-09 2.014093683118786e-09 -6.327197401921883e-09 ] [ 2.804201802992993e-09 -6.626327784931268e-09 1.127216994490685e-08 ] [ -4.965285258786148e-09 1.269349320089626e-08 5.252920344881909e-09 ] [ 8.998139284905569e-09 -8.548056465752944e-09 -9.253842990685712e-09 ] [ 1.962761545942059e-09 4.66797366669168e-10 -9.440498971811662e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4054044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.026258926100079e-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" [ [ -8.010883169999999e-15 -6.088271209199999e-15 -1.13754541014e-14 ] [ 1.00937127942e-14 -1.50604603596e-14 1.2817413072e-15 ] [ 2.403264951e-15 2.33917788564e-14 -3.204353268e-16 ] [ -5.4474005556e-15 -1.81045959642e-14 4.3258769118e-15 ] [ 9.613059803999998e-16 1.602176634e-14 5.9280535458e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658097671503e-18 } }