{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3218785 0.9859768 -12.1723484 ] [ -4.1597032 -2.8093503 13.2520282 ] [ -7.4846913 6.7951471 -6.2625111 ] [ -0.0118024 -3.6922749 -3.6834726 ] [ 5.9325935 1.4310617 -6.6189858 ] [ 3.8125276 -2.0814426 7.185575 ] [ 4.2329543 -0.6291178 8.2997148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.720059479686969e-09 1.579708990626091e-09 -1.950225218738728e-08 ] [ -6.664579271415028e-09 -4.50107540738089e-09 2.123208993514908e-08 ] [ -1.199179751356308e-08 1.088702590821286e-08 -1.003364895458564e-08 ] [ -1.89095295051216e-11 -5.915676571084687e-09 -5.901573731699227e-09 ] [ 9.505062684720278e-09 2.292813617552318e-09 -1.06047843895378e-08 ] [ 6.108342637200098e-09 -3.334838698732208e-09 1.151256036685455e-08 ] [ 6.781940472249827e-09 -1.007957839193485e-09 1.329760912142398e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.032764 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.568731985923637e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9786553 2.0547139 1.2110341 ] [ 1.8244202 1.6186691 3.9306736 ] [ 2.2438367 4.0136868 2.6274686 ] [ 3.3985843 0.289776 2.0958949 ] [ 4.5716028 2.7715666 1.8218624 ] [ 4.5413278 1.1579502 4.0592039 ] [ 3.8276579 3.4594538 4.3877345 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9786553e-10 2.0547139e-10 1.2110341e-10 ] [ 1.8244202e-10 1.6186691e-10 3.9306736e-10 ] [ 2.2438367e-10 4.0136868e-10 2.6274686e-10 ] [ 3.3985843e-10 2.89776e-11 2.0958949e-10 ] [ 4.5716028e-10 2.7715666e-10 1.8218624e-10 ] [ 4.5413278e-10 1.1579502e-10 4.0592039e-10 ] [ 3.8276579e-10 3.4594538e-10 4.3877345e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.41e-05 -1.3e-06 2.05e-05 ] [ -1.08e-05 -7.8e-06 7e-06 ] [ 4.52e-05 -3.42e-05 4.66e-05 ] [ -2.12e-05 -1.18e-05 -2.59e-05 ] [ 2.37e-05 6e-06 -2.26e-05 ] [ -6e-06 1.09e-05 2.5e-06 ] [ -4.51e-05 3.82e-05 -2.81e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.25906905394e-14 -2.0828296242e-15 3.2844620997e-14 ] [ -1.73035076472e-14 -1.24969777452e-14 1.1215236438e-14 ] [ 7.24183838568e-14 -5.479444088279999e-14 7.466143114439999e-14 ] [ -3.39661446408e-14 -1.89056842812e-14 -4.149637482059999e-14 ] [ 3.79715862258e-14 9.613059803999999e-15 -3.62091919284e-14 ] [ -9.613059803999999e-15 1.74637253106e-14 4.005441585e-15 ] [ -7.225816619339999e-14 6.12031474188e-14 -4.50211634154e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.270251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.407869915151513e-18 } }