{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992977 1.520628 1.322916 ] [ 2.351443 2.977576 3.35114 ] [ 0.8368319 3.514349 1.69894 ] [ 2.887807 3.844369 0.5466762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992977e-10 1.520628e-10 1.322916e-10 ] [ 2.351443e-10 2.977576e-10 3.35114e-10 ] [ 8.368319e-11 3.514349e-10 1.69894e-10 ] [ 2.887807e-10 3.844369e-10 5.466762e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6512363 -5.273914 -1.8590756 ] [ 1.1175804 -0.7708385 6.9635393 ] [ -5.1990302 4.0091559 -0.2422019 ] [ 2.4302135 2.0355966 -4.8622618 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.645572195276295e-09 -8.449741710909812e-09 -2.978567462619733e-09 ] [ 1.790561188744312e-09 -1.235019423112541e-09 1.1156819864482e-08 ] [ -8.329764637273149e-09 6.423375852122382e-09 -3.880502216933395e-10 ] [ 3.89363125325254e-09 3.261385281899969e-09 -7.790202180168924e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1440085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465031663909648e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7450111 1.6831137 1.4803236 ] [ 1.8187498 2.538868 3.394838 ] [ 1.1046166 4.1298435 1.9123269 ] [ 2.4006814 3.5050967 0.1321836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7450111e-10 1.6831137e-10 1.4803236e-10 ] [ 1.8187498e-10 2.538868e-10 3.394838e-10 ] [ 1.1046166e-10 4.1298435e-10 1.9123269e-10 ] [ 2.4006814e-10 3.5050967e-10 1.321836e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1352007 0.2591381 0.0525826 ] [ -0.0031568 -0.0557049 0.0108982 ] [ 0.1325649 -0.1624592 -0.0244213 ] [ 0.0057926 -0.040974 -0.0390595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.166154006557946e-10 4.151850053785324e-10 8.424661238087808e-11 ] [ -5.05775115654144e-12 -8.924908844400193e-11 1.746084124880256e-11 ] [ 2.1239238351869e-10 -2.602883320738713e-10 -3.912723590954304e-11 ] [ 9.28076829364608e-12 -6.56475848606592e-11 -6.25802177201376e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.591451 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.857155179334878e-18 } }