{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3591077 0.0526383 -1.5956135 ] [ -0.0695866 -2.9290796 -3.578068 ] [ 0.4633237 -0.743697 5.1626538 ] [ -9.4448609 6.5782825 5.2422396 ] [ 9.9449843 -1.732171 -9.9655435 ] [ -2.9750508 7.1050195 -4.638538 ] [ 4.440298 -8.3309928 9.3728696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.779707234029482e-09 8.433585431348218e-11 -2.556454666594959e-09 ] [ -1.114900245595044e-10 -4.692902894246066e-09 -5.732696944463111e-09 ] [ 7.423264061184257e-10 -1.191533956175898e-09 8.271483287791309e-09 ] [ -1.513233544536021e-08 1.05395705133511e-08 8.398993796949506e-09 ] [ 1.593362147095684e-08 -2.775243902292414e-09 -1.596656094081058e-08 ] [ -4.766556876723007e-09 1.138349622701436e-08 -7.431757199521091e-09 ] [ 7.114141703596932e-09 -1.334772200218224e-08 1.501699266664893e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3339765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.33525024166051e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7921476 3.1218964 2.6998535 ] [ 2.5865633 2.2739588 1.3782972 ] [ 2.2166947 1.6910888 4.3767144 ] [ 1.7529291 5.1599146 3.5481631 ] [ 4.339372 3.6942626 2.0800511 ] [ 3.1209512 5.860976 1.5408786 ] [ 3.6265029 3.7962928 4.419384 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.921476e-11 3.1218964e-10 2.6998535e-10 ] [ 2.5865633e-10 2.2739588e-10 1.3782972e-10 ] [ 2.2166947e-10 1.6910888e-10 4.3767144e-10 ] [ 1.7529291e-10 5.1599146e-10 3.5481631e-10 ] [ 4.339372e-10 3.6942626e-10 2.0800511e-10 ] [ 3.1209512e-10 5.860976e-10 1.5408786e-10 ] [ 3.6265029e-10 3.7962928e-10 4.419384e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.35e-05 4.7e-06 2.83e-05 ] [ 3.77e-05 -5.9e-06 -2.1e-06 ] [ 1.39e-05 2.45e-05 -2.52e-05 ] [ -2.3e-06 -2.8e-06 -1.12e-05 ] [ -1.55e-05 -5.91e-05 -2.3e-06 ] [ -6.6e-06 2.75e-05 2.32e-05 ] [ -1.37e-05 1.1e-05 -1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.162938455899999e-14 7.530230179799999e-15 4.53415987422e-14 ] [ 6.040205910179999e-14 -9.452842140600001e-15 -3.364570931399999e-15 ] [ 2.22702552126e-14 3.925332753299999e-14 -4.037485117679999e-14 ] [ -3.685006258199999e-15 -4.486094575199999e-15 -1.79443783008e-14 ] [ -2.4833737827e-14 -9.468863906939999e-14 -3.685006258199999e-15 ] [ -1.05743657844e-14 4.4059857435e-14 3.71704979088e-14 ] [ -2.19498198858e-14 1.7623942974e-14 -1.69830723204e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826168899254e-18 } }