{ "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" [ [ 1.137105 0.4960836 2.336745 ] [ 0.1995221 2.603398 2.709633 ] [ 1.958667 0.0128645 0.3845919 ] [ 2.315861 1.899112 1.511593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137105e-10 4.960836e-11 2.336745e-10 ] [ 1.995221e-11 2.603398e-10 2.709633e-10 ] [ 1.958667e-10 1.28645e-12 3.845919e-11 ] [ 2.315861e-10 1.899112e-10 1.511593e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0601087 -5.3532057 5.9100097 ] [ 0.0697312 0.8163796 -0.1877691 ] [ 0.8500086 -2.6956581 -4.2534243 ] [ 4.1403689 7.2324842 -1.4688162 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.10718785784668e-09 -8.5767810188733e-09 9.46887937004122e-09 ] [ 1.117216983803289e-10 1.307984308818056e-09 -3.008392621286573e-10 ] [ 1.361863906398939e-09 -4.318920385490149e-09 -6.814736971802606e-09 ] [ 6.633602253067414e-09 1.158771709554539e-08 -2.353302975892297e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3220471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333338930081644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.94237 0.3056049 2.4629571 ] [ 0.3273844 2.6185416 2.7006905 ] [ 2.0346016 -0.0199308 0.3450673 ] [ 2.306799 2.1072423 1.433848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.4237e-11 3.056049e-11 2.4629571e-10 ] [ 3.273844000000001e-11 2.6185416e-10 2.7006905e-10 ] [ 2.0346016e-10 -1.99308e-12 3.450673e-11 ] [ 2.306799e-10 2.1072423e-10 1.433848e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -2.1e-06 1.4e-06 ] [ -3.7e-06 1e-06 1.3e-06 ] [ -9e-07 -8e-07 -8e-07 ] [ 5.2e-06 1.9e-06 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -3.36457090368e-15 2.24304726912e-15 ] [ -5.928053496960001e-15 1.6021766208e-15 2.08282960704e-15 ] [ -1.44195895872e-15 -1.28174129664e-15 -1.28174129664e-15 ] [ 8.33131842816e-15 3.04413557952e-15 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.347335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657825822458557e-18 } }