{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1317636 4.4834925 1.0705732 ] [ 0.0523462 -0.6252755 0.0889205 ] [ -0.1575549 -3.1791618 0.6427429 ] [ -1.2955259 0.7703438 1.1184524 ] [ 2.5232491 0.8635794 -4.020288 ] [ 3.5835956 1.3366819 -1.1196861 ] [ 0.4256534 -3.6496603 2.2192851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.221991663392443e-09 7.183346863032144e-09 1.715247351895042e-09 ] [ 8.386785782772097e-11 -1.00180178765903e-09 1.424663462098464e-10 ] [ -2.524307772724819e-10 -5.093578709700445e-09 1.029787647565192e-09 ] [ -2.075661308620879e-09 1.234226826338231e-09 1.79195828675765e-09 ] [ 4.042690716474642e-09 1.383606724884492e-09 -6.44121144248279e-09 ] [ 5.741553088721749e-09 2.141600489626524e-09 -1.793934892054731e-09 ] [ 6.819719260440307e-10 -5.847400406521914e-09 3.55568670210979e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.263165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.086299260561284e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7182416 5.245264 2.865508 ] [ 5.3704977 2.6478647 1.2044456 ] [ 3.2202823 2.8355766 2.3577718 ] [ 5.5675456 2.8264172 3.5932983 ] [ 4.414306 4.8512157 1.1136793 ] [ 5.16294 5.2763799 3.447369 ] [ 3.5547268 3.776592 4.664083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7182416e-10 5.245264e-10 2.865508e-10 ] [ 5.370497699999999e-10 2.6478647e-10 1.2044456e-10 ] [ 3.2202823e-10 2.8355766e-10 2.3577718e-10 ] [ 5.5675456e-10 2.8264172e-10 3.5932983e-10 ] [ 4.414306e-10 4.8512157e-10 1.1136793e-10 ] [ 5.16294e-10 5.276379900000001e-10 3.447369e-10 ] [ 3.5547268e-10 3.776592e-10 4.664083e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.04e-05 -1.21e-05 4.09e-05 ] [ -0.0 -4.91e-05 1.33e-05 ] [ 1.78e-05 1.43e-05 1.1e-06 ] [ -3.54e-05 5.6e-05 -5e-05 ] [ 4.27e-05 4e-07 3.27e-05 ] [ -3.45e-05 -3e-05 4.5e-06 ] [ 2.99e-05 2.04e-05 -4.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.268440306432e-14 -1.938633711168e-14 6.552902379072e-14 ] [ 0.0 -7.866687208128001e-14 2.130894905664e-14 ] [ 2.851874385024e-14 2.291112567744e-14 1.76239428288e-15 ] [ -5.671705237632e-14 8.97218907648e-14 -8.010883104e-14 ] [ 6.841294170816001e-14 6.408706483200001e-16 5.239117550016001e-14 ] [ -5.52750934176e-14 -4.8065298624e-14 7.2097947936e-15 ] [ 4.790508096192e-14 3.268440306432e-14 -6.8092506384e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.602861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.461159883659211e-18 } }