{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2533903 -0.6514268 -1.301943 ] [ 0.0902705 -2.0590189 1.2611475 ] [ -2.9982758 2.5845917 -0.5001168 ] [ -0.2533582 1.8480554 -0.7134094 ] [ 2.9079732 -1.7222015 1.2543217 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.059760145974983e-10 -1.043700789122557e-09 -2.085942636214214e-09 ] [ 1.446292846479264e-10 -3.298911943365333e-09 2.020581039880368e-09 ] [ -4.803767389470417e-09 4.140972396053727e-09 -8.012754446293096e-10 ] [ -4.059245847279705e-10 2.960911155823193e-09 -1.143007861738956e-09 ] [ 4.659086674952963e-09 -2.759270979606691e-09 2.009644902702111e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.0308404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.126464811345612e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.824474 2.4808316 0.7199241 ] [ 1.3139442 2.3356509 3.7264313 ] [ 0.3530959 3.714125 2.0797318 ] [ 2.3294159 4.9281206 2.4739511 ] [ 3.2921264 2.7822779 2.5338067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.824474e-10 2.4808316e-10 7.199241e-11 ] [ 1.3139442e-10 2.3356509e-10 3.7264313e-10 ] [ 3.530959e-11 3.714125e-10 2.0797318e-10 ] [ 2.3294159e-10 4.9281206e-10 2.4739511e-10 ] [ 3.2921264e-10 2.7822779e-10 2.5338067e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 4.2e-06 1.08e-05 ] [ -7.1e-06 -6.1e-06 3.9e-06 ] [ 6e-06 -8.4e-06 -3.3e-06 ] [ 4.6e-06 1.26e-05 -1.8e-06 ] [ -3.7e-06 -2.3e-06 -9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 6.72914180736e-15 1.730350750464e-14 ] [ -1.137545400768e-14 -9.77327738688e-15 6.24848882112e-15 ] [ 9.6130597248e-15 -1.345828361472e-14 -5.28718284864e-15 ] [ 7.370012455680001e-15 2.018742542208e-14 -2.88391791744e-15 ] [ -5.928053496960001e-15 -3.68500622784e-15 -1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }