{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5839357 -39.1856677 -12.1898163 ] [ -0.691347 1.4050773 -7.3707297 ] [ -17.3294944 1.0803619 -11.7314765 ] [ -9.4503758 -1.473819 28.6807595 ] [ -5.6084639 40.4806063 2.0278688 ] [ 12.7222188 9.8917039 -11.6735285 ] [ 22.941398 -12.1982627 12.2569226 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.139921368190482e-09 -6.278236065937772e-08 -1.953023868770676e-08 ] [ -1.107660000260218e-09 2.251182000476788e-09 -1.18092108035762e-08 ] [ -2.776491077796453e-08 1.730930578183068e-09 -1.879589737576461e-08 ] [ -1.51411711645341e-08 -2.361318345090835e-09 4.59516423376875e-08 ] [ -8.98574973918079e-09 6.485708100966918e-08 3.249003981409751e-09 ] [ 2.038324152606223e-08 1.584825672845618e-08 -1.87030544449425e-08 ] [ 3.675617152406787e-08 -1.954377131231669e-08 1.963775483267515e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.051088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.091014806960343e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3206072 0.5210965 2.8776042 ] [ 3.0313464 3.3812304 0.7110652 ] [ 1.283919 2.4619125 2.0129734 ] [ 3.1528195 3.2751655 5.1363466 ] [ 1.1895232 3.83444 3.9367398 ] [ 4.9946442 2.8219524 1.9106676 ] [ 4.1960934 1.6323358 3.7923568 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3206072e-10 5.210965e-11 2.8776042e-10 ] [ 3.0313464e-10 3.3812304e-10 7.110652e-11 ] [ 1.283919e-10 2.4619125e-10 2.0129734e-10 ] [ 3.1528195e-10 3.2751655e-10 5.136346600000001e-10 ] [ 1.1895232e-10 3.83444e-10 3.9367398e-10 ] [ 4.9946442e-10 2.8219524e-10 1.9106676e-10 ] [ 4.1960934e-10 1.6323358e-10 3.7923568e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-07 -9e-07 -7e-06 ] [ 2.01e-05 -9.5e-06 6.1e-06 ] [ -1.09e-05 -1.3e-06 1.59e-05 ] [ -1.2e-05 -1.3e-06 -1.99e-05 ] [ -1.2e-06 7.9e-06 1.01e-05 ] [ -6.6e-06 2.7e-06 4.6e-06 ] [ 1.08e-05 2.5e-06 -9.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-16 -1.44195895872e-15 -1.12152363456e-14 ] [ 3.220375007808e-14 -1.52206778976e-14 9.77327738688e-15 ] [ -1.746372516672e-14 -2.08282960704e-15 2.547460827072e-14 ] [ -1.92261194496e-14 -2.08282960704e-15 -3.188331475392e-14 ] [ -1.92261194496e-15 1.265719530432e-14 1.618198387008e-14 ] [ -1.057436569728e-14 4.32587687616e-15 7.370012455680001e-15 ] [ 1.730350750464e-14 4.005441552e-15 -1.586154854592e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }