{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2437888 -3.8327551 -8.5621452 ] [ 1.167509 -7.0967889 5.697613 ] [ -0.817268 4.0696295 -1.2952239 ] [ -11.7451899 2.1472894 0.1608857 ] [ 10.1511601 4.712625 3.9988703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.992769336572887e-09 -6.140750614471967e-09 -1.371806886333494e-08 ] [ 1.870555624373587e-09 -1.137030925833295e-08 9.128582342966151e-09 ] [ -1.309407682527975e-09 6.520265240217993e-09 -2.075177451281397e-09 ] [ -1.881786866463629e-08 3.44033687477166e-09 2.577673071610426e-10 ] [ 1.626395138621779e-08 7.550457597597601e-09 6.406896504271483e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.601964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.975335751363252e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2074158 2.3279806 1.218201 ] [ 1.8457689 2.1532254 4.4471184 ] [ 1.6148038 5.0262638 2.9373036 ] [ 0.2724272 2.9374131 2.6739015 ] [ 3.5062319 3.4009 3.0611805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2074158e-10 2.3279806e-10 1.218201e-10 ] [ 1.8457689e-10 2.1532254e-10 4.4471184e-10 ] [ 1.6148038e-10 5.0262638e-10 2.9373036e-10 ] [ 2.724272e-11 2.9374131e-10 2.6739015e-10 ] [ 3.5062319e-10 3.4009e-10 3.0611805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 9e-07 1.8e-06 ] [ 1e-07 1.1e-06 -1.7e-06 ] [ 4e-07 -1.9e-06 -0.0 ] [ 2e-06 3e-07 3e-07 ] [ -2.4e-06 -3e-07 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 1.44195895872e-15 2.88391791744e-15 ] [ 1.6021766208e-16 1.76239428288e-15 -2.72370025536e-15 ] [ 6.408706483200001e-16 -3.04413557952e-15 0.0 ] [ 3.2043532416e-15 4.8065298624e-16 4.8065298624e-16 ] [ -3.84522388992e-15 -4.8065298624e-16 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }