{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.3007931 -23.1695016 -24.1005545 ] [ -22.5288933 -47.2874663 5.2489809 ] [ -26.1240629 45.6969027 17.850052 ] [ 25.4954823 9.3640237 -72.1218486 ] [ 33.8493738 -61.7334407 43.8714377 ] [ 9.6088931 77.1294821 29.2519324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.252545608851796e-08 -3.71216337791082e-08 -3.861334496821624e-08 ] [ -3.609526613775776e-08 -7.576287296272788e-08 8.409794481005744e-09 ] [ -4.185536281868865e-08 7.32145091489124e-08 2.859893599446429e-08 ] [ 4.084826567708021e-08 1.500281984875712e-08 -1.155519396757972e-07 ] [ 5.423267533108006e-08 -9.89078754110832e-08 7.028979180382373e-08 ] [ 1.539514387658644e-08 1.235750529950321e-07 4.686676220450204e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 65.621254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.051368389863785e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4786759 0.4897787 0.2868529 ] [ 0.5369863 -0.4529329 2.6463741 ] [ -0.0348362 1.9946161 2.2695829 ] [ 2.877208 1.0771429 0.4622556 ] [ 2.9355147 0.1344447 2.8217823 ] [ 2.3636953 2.5819915 2.4449758 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.786759e-11 4.897787e-11 2.868529e-11 ] [ 5.369863e-11 -4.529329000000001e-11 2.6463741e-10 ] [ -3.48362e-12 1.9946161e-10 2.2695829e-10 ] [ 2.877208e-10 1.0771429e-10 4.622556e-11 ] [ 2.9355147e-10 1.344447e-11 2.8217823e-10 ] [ 2.3636953e-10 2.5819915e-10 2.4449758e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8e-06 -1.03e-05 -3.7e-06 ] [ -1.09e-05 3.4e-06 1.08e-05 ] [ 2.1e-06 4.8e-06 -8.4e-06 ] [ 9.4e-06 8.9e-06 -1.18e-05 ] [ 1.38e-05 -1.09e-05 -1.1e-06 ] [ -6.7e-06 4.2e-06 1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249697764224e-14 -1.650241919424e-14 -5.928053496960001e-15 ] [ -1.746372516672e-14 5.44740051072e-15 1.730350750464e-14 ] [ 3.36457090368e-15 7.69044777984e-15 -1.345828361472e-14 ] [ 1.506046023552e-14 1.425937192512e-14 -1.890568412544e-14 ] [ 2.211003736704e-14 -1.746372516672e-14 -1.76239428288e-15 ] [ -1.073458335936e-14 6.72914180736e-15 2.291112567744e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }