{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7537184 -18.7954813 -8.8180274 ] [ -4.0151337 -6.3430783 -16.5364923 ] [ -39.4455734 32.5057376 13.1655646 ] [ 62.6644014 -50.1994847 24.5634013 ] [ -0.8971593 0.365539 -3.3539093 ] [ -7.5528165 42.4667677 -9.0205369 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.722935620714678e-08 -3.011368071554359e-08 -1.412803734185381e-08 ] [ -6.432953343526201e-09 -1.016273175616381e-08 -2.649438135309922e-08 ] [ -6.319877549553037e-08 5.207993282457951e-08 2.109355980175211e-08 ] [ 1.003994388795068e-07 -8.04284407625473e-08 3.935490729018832e-08 ] [ -1.437407655593293e-09 5.856580397906112e-10 -5.373555068743694e-09 ] [ -1.210094601749248e-08 6.803926236988459e-08 -1.445249332824371e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 24.622602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.944975726766332e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0403095 0.6966626 1.8419361 ] [ 0.5988042 2.6075722 0.3750452 ] [ -0.2980301 2.5493304 2.6234616 ] [ 3.31148 0.8785449 2.6438184 ] [ 2.7964767 1.5903133 0.3874427 ] [ 2.0677287 2.9219631 2.3093943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0403095e-10 6.966626e-11 1.8419361e-10 ] [ 5.988042e-11 2.6075722e-10 3.750452e-11 ] [ -2.980301e-11 2.5493304e-10 2.6234616e-10 ] [ 3.31148e-10 8.785448999999999e-11 2.6438184e-10 ] [ 2.7964767e-10 1.5903133e-10 3.874427e-11 ] [ 2.0677287e-10 2.9219631e-10 2.3093943e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -3.65e-05 -1.13e-05 ] [ -2.13e-05 2.84e-05 -1.04e-05 ] [ 9.4e-06 -1.58e-05 2.05e-05 ] [ -2.15e-05 7.1e-06 3.03e-05 ] [ 2.81e-05 -2.9e-05 -4.23e-05 ] [ 1.03e-05 4.57e-05 1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 -5.84794466592e-14 -1.810459581504e-14 ] [ -3.412636202304e-14 4.550181603071999e-14 -1.666263685632e-14 ] [ 1.506046023552e-14 -2.531439060864e-14 3.28446207264e-14 ] [ -3.44467973472e-14 1.137545400768e-14 4.854595161024e-14 ] [ 4.502116304448e-14 -4.64631220032e-14 -6.777207105984e-14 ] [ 1.650241919424e-14 7.321947157056e-14 2.114873139456e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }