{ "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" [ [ 1.203026 0.2649124 0.0761432 ] [ 0.4390709 0.810708 2.186548 ] [ 0.3000789 2.890506 0.2564829 ] [ 2.996181 0.8499925 2.546793 ] [ 2.861384 1.542152 0.2554234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.203026e-10 2.649124e-11 7.61432e-12 ] [ 4.390709e-11 8.107080000000001e-11 2.186548e-10 ] [ 3.000789e-11 2.890506e-10 2.564829e-11 ] [ 2.996181e-10 8.499925000000001e-11 2.546793e-10 ] [ 2.861384e-10 1.542152e-10 2.554234e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5449571 2.3751299 -0.708834 ] [ 1.9325088 4.9329121 -3.0823198 ] [ 2.6435165 -9.1446865 4.505697 ] [ -3.1691688 0.4488648 -1.2770334 ] [ 1.1381006 1.3877796 0.5624903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.077470800152401e-09 3.805377628494756e-09 -1.135677272184756e-09 ] [ 3.096220444359379e-09 7.90339650419587e-09 -4.938420762075553e-09 ] [ 4.235380367893461e-09 -1.465140303555524e-08 7.218922453283897e-09 ] [ -5.077568200561819e-09 7.191606943850832e-10 -2.046033074317576e-09 ] [ 1.82343818846138e-09 2.223468048261866e-09 9.0120881551165e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.64911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.866393184889574e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.885004 0.1667016 -0.2418692 ] [ 0.5816515 0.8499986 2.1907425 ] [ 0.5446769 2.6500328 0.3921213 ] [ 2.9092956 1.0533664 2.6436141 ] [ 2.8791128 1.6381715 0.3367818 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.85004e-11 1.667016e-11 -2.418692e-11 ] [ 5.816515e-11 8.499986000000001e-11 2.1907425e-10 ] [ 5.446769e-11 2.6500328e-10 3.921213e-11 ] [ 2.9092956e-10 1.0533664e-10 2.6436141e-10 ] [ 2.8791128e-10 1.6381715e-10 3.367818e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.88e-05 8.6e-05 2.97e-05 ] [ 1.79e-05 3.06e-05 -6.28e-05 ] [ 2.18e-05 -9.03e-05 7.1e-06 ] [ 1.97e-05 1.3e-06 1.36e-05 ] [ -7.81e-05 -2.77e-05 1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.012092071919999e-14 1.37787190524e-13 4.75846460298e-14 ] [ 2.86789617486e-14 4.90266050004e-14 -1.006166926152e-13 ] [ 3.492745062119999e-14 -1.446765500502e-13 1.13754541014e-14 ] [ 3.15628796898e-14 2.0828296242e-15 2.17896022224e-14 ] [ -1.251299951154e-13 -4.438029276179999e-14 1.98669902616e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.946258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.554872196733557e-18 } }