{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6624345 -1.255193 1.8458407 ] [ 0.4171066 -3.5579226 -3.0422984 ] [ 1.6572223 4.7145548 2.0812048 ] [ -1.2412866 3.829222 -5.9736017 ] [ 3.8293923 -3.7306612 5.0888546 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.470043551911338e-09 -2.011040879191814e-09 2.957362815261107e-09 ] [ 6.682784429013772e-10 -5.70042040833595e-09 -4.874299369977247e-09 ] [ 2.655162824528403e-09 7.553549478040419e-09 3.33445767365674e-09 ] [ -1.988760370232321e-09 6.135089964253018e-09 -9.570764985711135e-09 ] [ 6.13536281493154e-09 -5.977178154765674e-09 8.153243866770537e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.483588 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.000091283729943e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3890035 2.2220061 1.3047725 ] [ 2.2656156 4.2892389 2.8109131 ] [ 4.4479179 5.6097407 2.5851211 ] [ 3.4844053 4.4066766 0.5402713 ] [ 4.5053626 3.0517057 2.4836583 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3890035e-10 2.2220061e-10 1.3047725e-10 ] [ 2.2656156e-10 4.2892389e-10 2.8109131e-10 ] [ 4.4479179e-10 5.6097407e-10 2.5851211e-10 ] [ 3.4844053e-10 4.4066766e-10 5.402713e-11 ] [ 4.5053626e-10 3.0517057e-10 2.4836583e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-05 4e-05 4.9e-06 ] [ -9.8e-06 1.29e-05 1.13e-05 ] [ -8.1e-06 2.9e-06 1.35e-05 ] [ -1.9e-05 -2.55e-05 -2.76e-05 ] [ 1.9e-06 -3.03e-05 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-14 6.4087064832e-14 7.850665441919999e-15 ] [ -1.570133088384e-14 2.066807840832e-14 1.810459581504e-14 ] [ -1.297763062848e-14 4.646312200320001e-15 2.16293843808e-14 ] [ -3.04413557952e-14 -4.08555038304e-14 -4.422007473408001e-14 ] [ 3.04413557952e-15 -4.854595161024e-14 -3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }