{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4308353 -0.3849114 1.5849475 ] [ 0.5521972 -1.16761 -0.0619077 ] [ -2.5214958 1.7002751 -1.9848165 ] [ 1.8178189 -1.8687876 -1.1424307 ] [ 0.5141782 -0.7731555 2.0712776 ] [ 0.3664544 1.0640832 -2.2206256 ] [ 2.7016824 1.4301062 1.7535554 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.496804107475354e-09 -6.166960461593971e-10 2.539365829695408e-09 ] [ 8.847174439112219e-10 -1.870717444212288e-09 -9.918706958750017e-11 ] [ -4.039881620205392e-09 2.724141014148382e-09 -3.180026592878083e-09 ] [ 2.912466942428373e-09 -2.994127801960942e-09 -1.830375758424179e-09 ] [ 8.238042909650266e-10 -1.238731666342935e-09 3.318552545906735e-09 ] [ 5.871246722692916e-10 1.704849225626051e-09 -3.557834419869973e-09 ] [ 4.328572378106834e-09 2.291282718901129e-09 2.809505465157592e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.076312 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.575709123508649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5593978 3.1947832 4.7892047 ] [ 1.6718431 4.0279323 2.7092481 ] [ 3.4052035 3.5686541 1.1662687 ] [ 4.2842468 1.5342856 1.9918582 ] [ 4.68648 2.3659124 4.1689152 ] [ 5.1395894 5.100128 1.6589942 ] [ 6.0271584 4.2669524 3.7389259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.559397800000001e-10 3.1947832e-10 4.789204700000001e-10 ] [ 1.6718431e-10 4.0279323e-10 2.7092481e-10 ] [ 3.4052035e-10 3.5686541e-10 1.1662687e-10 ] [ 4.2842468e-10 1.5342856e-10 1.9918582e-10 ] [ 4.68648e-10 2.3659124e-10 4.1689152e-10 ] [ 5.139589400000001e-10 5.100128e-10 1.6589942e-10 ] [ 6.0271584e-10 4.2669524e-10 3.7389259e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.41e-05 1.32e-05 3.05e-05 ] [ 3.08e-05 -1.7e-05 3.86e-05 ] [ 2.04e-05 -3.3e-06 -3.36e-05 ] [ -5.2e-06 2.31e-05 -4.5e-06 ] [ -1.66e-05 -1.1e-05 -5e-05 ] [ -1.6e-05 -2.87e-05 -4.12e-05 ] [ 1.06e-05 2.35e-05 6.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.861245656128e-14 2.114873139456e-14 4.88663869344e-14 ] [ 4.934703992064001e-14 -2.72370025536e-14 6.184401756288e-14 ] [ 3.268440306432e-14 -5.28718284864e-15 -5.383313445888e-14 ] [ -8.33131842816e-15 3.701027994048e-14 -7.2097947936e-15 ] [ -2.659613190528e-14 -1.76239428288e-14 -8.010883104e-14 ] [ -2.56348259328e-14 -4.598246901696e-14 -6.600967677696001e-14 ] [ 1.698307218048e-14 3.76511505888e-14 9.645103257216e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }