{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4001403 -3.327246 -6.353096 ] [ -0.7724948 -6.3027821 9.1932919 ] [ -3.3801028 -2.049293 0.3967217 ] [ -4.0974901 7.4802648 0.4541228 ] [ 8.650228 4.1990564 -3.6910405 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.410954336998983e-10 -5.330835752850317e-09 -1.0178781880898e-08 ] [ -1.237673108249572e-09 -1.009817012661673e-08 1.472927735037001e-08 ] [ -5.415521682060618e-09 -3.283329333769094e-09 6.356182327040314e-10 ] [ -6.564902842179454e-09 1.198470537995319e-08 7.275849331322342e-10 ] [ 1.385919306618954e-08 6.727629993500614e-09 -5.913698795525943e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3114115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.331634919114826e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0970624 2.0567355 1.6628238 ] [ 2.3484871 2.3964977 5.0411029 ] [ 0.4487203 2.2167294 3.3815169 ] [ 1.3801206 4.5063982 3.9158998 ] [ 3.4900438 3.4269562 3.0334525 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0970624e-10 2.0567355e-10 1.6628238e-10 ] [ 2.3484871e-10 2.3964977e-10 5.041102900000001e-10 ] [ 4.487203e-11 2.2167294e-10 3.3815169e-10 ] [ 1.3801206e-10 4.5063982e-10 3.9158998e-10 ] [ 3.4900438e-10 3.4269562e-10 3.0334525e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 -1.88e-05 -1.59e-05 ] [ 8.1e-06 5e-07 2.36e-05 ] [ -2.18e-05 -1.9e-05 -2.08e-05 ] [ 5.5e-06 2.5e-05 1.81e-05 ] [ 1.32e-05 1.23e-05 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 -3.012092047104e-14 -2.547460827072e-14 ] [ 1.297763062848e-14 8.010883104e-16 3.781136825088e-14 ] [ -3.492745033344e-14 -3.04413557952e-14 -3.332527371264e-14 ] [ 8.8119714144e-15 4.005441552e-14 2.899939683648e-14 ] [ 2.114873139456e-14 1.970677243584e-14 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }