{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.496871e-11 1.367202e-11 1.9338541e-10 ] [ 1.3411265e-10 5.0609273e-10 -3.36431e-12 ] [ 5.83185e-11 4.3850235e-10 5.3747209e-10 ] [ 4.930349100000001e-10 8.94342e-11 -1.175993e-11 ] [ 4.0990298e-10 -1.461731e-11 5.414991900000001e-10 ] [ 5.795762800000001e-10 4.789871e-10 3.6673584e-10 ] ] "source-value" [ [ -0.1496871 0.1367202 1.9338541 ] [ 1.3411265 5.0609273 -0.0336431 ] [ 0.583185 4.3850235 5.3747209 ] [ 4.9303491 0.894342 -0.1175993 ] [ 4.0990298 -0.1461731 5.4149919 ] [ 5.7957628 4.789871 3.6673584 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.408706483200001e-16 0.0 -4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ -6.408706483200001e-16 0.0 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 6.408706483200001e-16 0.0 4.8065298624e-16 ] [ 6.408706483200001e-16 1.6021766208e-16 -1.6021766208e-16 ] ] "source-value" [ [ -4e-07 0.0 -3e-07 ] [ 0.0 0.0 0.0 ] [ -4e-07 -0.0 1e-07 ] [ -0.0 -0.0 -0.0 ] [ 4e-07 -0.0 3e-07 ] [ 4e-07 1e-07 -1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.188984843017963e-31 "source-value" 1.9904078e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.042501178980401e-09 -3.51947975352698e-09 -6.457242821750515e-10 ] [ -2.058342740656003e-09 3.58042334782897e-09 -3.553198361600026e-09 ] [ -3.105492855825481e-09 2.672079246161459e-09 3.450436515536197e-09 ] [ 3.302048844971198e-09 -2.360371939360928e-09 -4.26173053079303e-09 ] [ 1.399356601719942e-09 -3.966976495687834e-09 3.561800287659439e-09 ] [ 4.504931488988408e-09 3.594325754802976e-09 1.44841621115481e-09 ] ] "source-value" [ [ -2.5231308 -2.1966865 -0.4030294 ] [ -1.2847165 2.2347245 -2.217732 ] [ -1.9382962 1.6677807 2.1535931 ] [ 2.0609768 -1.4732283 -2.659963 ] [ 0.8734097 -2.475992 2.2231009 ] [ 2.8117571 2.2434017 0.9040303 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.077518872195035e-18 "source-value" 12.966853 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.480644e-10 1.446872e-10 2.305559e-10 ] [ 2.063952e-10 3.613106000000001e-10 1.277693e-10 ] [ 1.847715e-10 3.513174e-10 3.941338e-10 ] [ 3.676983e-10 1.999062e-10 1.431631e-10 ] [ 3.525184e-10 1.303022e-10 4.049537e-10 ] [ 4.005288e-10 3.245475e-10 3.233925e-10 ] ] "source-value" [ [ 1.480644 1.446872 2.305559 ] [ 2.063952 3.613106 1.277693 ] [ 1.847715 3.513174 3.941338 ] [ 3.676983 1.999062 1.431631 ] [ 3.525184 1.303022 4.049537 ] [ 4.005288 3.245475 3.233925 ] ] } "instance-id" 1 }