{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5363124e-10 -1.612129e-11 -2.4370091e-10 ] [ -1.0547806e-10 3.3250389e-10 2.9420709e-10 ] [ 2.9722456e-10 -1.2502986e-10 3.1352801e-10 ] [ -1.8779269e-10 -1.5512474e-10 5.348999e-11 ] [ 3.1331231e-10 5.1111769e-10 -9.893689e-11 ] [ 4.2606258e-10 3.9743546e-10 4.2724127e-10 ] ] "source-value" [ [ 2.5363124 -0.1612129 -2.4370091 ] [ -1.0547806 3.3250389 2.9420709 ] [ 2.9722456 -1.2502986 3.1352801 ] [ -1.8779269 -1.5512474 0.5348999 ] [ 3.1331231 5.1111769 -0.9893689 ] [ 4.2606258 3.9743546 4.2724127 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 4.8065298624e-16 -6.408706483200001e-16 -6.408706483200001e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -6.408706483200001e-16 -1.6021766208e-16 3.2043532416e-16 ] [ 0.0 8.010883104e-16 -1.6021766208e-16 ] [ 1.6021766208e-16 0.0 3.2043532416e-16 ] ] "source-value" [ [ 3e-07 -4e-07 -4e-07 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ -4e-07 -1e-07 2e-07 ] [ 0.0 5e-07 -1e-07 ] [ 1e-07 -0.0 2e-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" 4.492470079667149e-31 "source-value" 2.8039793e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.051050593984094e-09 -8.219202914766279e-10 -8.147818255861859e-09 ] [ -5.353361394832792e-09 3.223936165783052e-09 3.350482163564996e-09 ] [ 4.215697753430177e-09 -4.788145206111645e-09 6.054429664020139e-09 ] [ -7.525221393208054e-09 -5.79719572145616e-09 -1.665240856077281e-09 ] [ 2.717568565214537e-09 4.863553891816865e-09 -5.150820154484754e-09 ] [ 3.894265875412039e-09 3.319771161444515e-09 5.55896743883876e-09 ] ] "source-value" [ [ 1.2801651 -0.5130023 -5.0854682 ] [ -3.3413054 2.0122227 2.0912065 ] [ 2.6312316 -2.9885252 3.7788778 ] [ -4.6968738 -3.618325 -1.0393616 ] [ 1.6961729 3.0355916 -3.2148891 ] [ 2.4306096 2.0720382 3.4696346 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.106021253675021e-18 "source-value" 19.38626 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.761721e-10 1.020444e-10 9.010763e-13 ] [ 5.084234e-11 2.183768e-10 2.158754e-10 ] [ 1.862989e-10 5.350959e-11 1.816496e-10 ] [ 5.578759e-11 1.863455e-11 8.245652999999999e-11 ] [ 2.554812e-10 2.767243e-10 4.680195e-11 ] [ 2.723778e-10 2.754915e-10 2.18144e-10 ] ] "source-value" [ [ 1.761721 1.020444 0.009010763 ] [ 0.5084234 2.183768 2.158754 ] [ 1.862989 0.5350959 1.816496 ] [ 0.5578759 0.1863455 0.8245653 ] [ 2.554812 2.767243 0.4680195 ] [ 2.723778 2.754915 2.18144 ] ] } "instance-id" 1 }