{ "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" [ [ -5.0629323 -1.4556701 -7.377072 ] [ -8.6464577 -3.7741478 8.6185342 ] [ -3.8762297 8.5261075 -2.9353608 ] [ 1.3721853 -6.9806044 -4.2534013 ] [ 8.9087392 3.208833 -7.2942223 ] [ 4.6786559 -4.0982823 4.9259118 ] [ 2.6260392 4.5737641 8.3156103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.111711763753171e-09 -2.332240601817598e-09 -1.18193722883583e-08 ] [ -1.385315237967614e-08 -6.046851368603754e-09 1.380841400080523e-08 ] [ -6.210404602190598e-09 1.366033010292754e-08 -4.702966447372785e-09 ] [ 2.198483207065434e-09 -1.118416116873361e-08 -6.814700121740327e-09 ] [ 1.42733736670445e-08 5.141117212651526e-09 -1.1686632435978e-08 ] [ 7.496033099747983e-09 -6.566172086498452e-09 7.892180722082846e-09 ] [ 4.207378611544336e-09 7.327977910074353e-09 1.332307641034367e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.9331267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.591462337018426e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5867371 1.9211816 1.9331621 ] [ 1.7836483 1.459369 4.2764143 ] [ 2.9359097 3.9230831 2.1648407 ] [ 3.5401522 0.5937829 1.5268928 ] [ 4.9425205 2.6746192 1.7676991 ] [ 4.4110932 1.2535788 3.9476369 ] [ 3.1860239 3.5402017 4.5172261 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5867371e-10 1.9211816e-10 1.9331621e-10 ] [ 1.7836483e-10 1.459369e-10 4.2764143e-10 ] [ 2.9359097e-10 3.9230831e-10 2.1648407e-10 ] [ 3.5401522e-10 5.937829e-11 1.5268928e-10 ] [ 4.9425205e-10 2.6746192e-10 1.7676991e-10 ] [ 4.4110932e-10 1.2535788e-10 3.9476369e-10 ] [ 3.1860239e-10 3.5402017e-10 4.517226100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -2.2e-06 6.1e-06 ] [ 8e-06 7.5e-06 -5.8e-06 ] [ -2.5e-06 4e-06 1e-07 ] [ -4.3e-06 -6.2e-06 -6.3e-06 ] [ 8.7e-06 5e-06 -5.7e-06 ] [ -3.2e-06 -2e-07 1.16e-05 ] [ -4.5e-06 -8e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 -3.52478856576e-15 9.77327738688e-15 ] [ 1.28174129664e-14 1.2016324656e-14 -9.292624400640001e-15 ] [ -4.005441552e-15 6.4087064832e-15 1.6021766208e-16 ] [ -6.889359469440001e-15 -9.93349504896e-15 -1.009371271104e-14 ] [ 1.393893660096e-14 8.010883104e-15 -9.13240673856e-15 ] [ -5.126965186560001e-15 -3.2043532416e-16 1.858524880128e-14 ] [ -7.2097947936e-15 -1.28174129664e-14 0.0 ] ] } "relaxed-potential-energy" { "source-value" -17.765666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846373471814145e-18 } }