{ "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" [ [ 0.0417064 1.393533 2.342657 ] [ 0.9221083 2.569653 0.2410471 ] [ 1.810038 0.5140043 0.5075901 ] [ 2.608454 2.928842 0.8878785 ] [ 2.606177 1.867368 2.693771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.17064e-12 1.393533e-10 2.342657e-10 ] [ 9.221083e-11 2.569653e-10 2.410471e-11 ] [ 1.810038e-10 5.140043e-11 5.075901e-11 ] [ 2.608454e-10 2.928842e-10 8.878785000000001e-11 ] [ 2.606177e-10 1.867368e-10 2.693771e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.0426193 0.6930116 -2.5210915 ] [ -12.0051684 -1.4992 -2.3702545 ] [ 0.3660124 0.4011889 3.0400929 ] [ 10.6247792 3.4471326 0.8628935 ] [ -3.0282425 -3.0421332 0.9883595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.476990129254861e-09 1.110326983463201e-09 -4.039233860197603e-09 ] [ -1.923440013924694e-08 -2.40198318990336e-09 -3.797566345245994e-09 ] [ 5.864165102028979e-10 6.427754761044692e-10 4.870765769440072e-09 ] [ 1.702277283540213e-08 5.522915260517518e-09 1.382507791940285e-09 ] [ -4.851779335612945e-09 -4.87403469039949e-09 1.583526483845577e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.818417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.053736803306528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0572298 0.9805597 2.1754659 ] [ 0.7314709 2.7906899 0.7206977 ] [ 1.9201825 0.6472395 0.6701985 ] [ 3.1381644 2.7288016 0.4937137 ] [ 2.1414361 2.1261096 2.6128679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.72298e-12 9.805597000000001e-11 2.1754659e-10 ] [ 7.314709e-11 2.7906899e-10 7.206977e-11 ] [ 1.9201825e-10 6.472395e-11 6.701985000000001e-11 ] [ 3.1381644e-10 2.7288016e-10 4.937137e-11 ] [ 2.1414361e-10 2.1261096e-10 2.6128679e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.14e-05 -9.2e-06 2.5e-06 ] [ 2.7e-06 1.07e-05 4.4e-06 ] [ 8.4e-06 -1.8e-06 3.6e-06 ] [ 3.1e-06 -4e-07 -1.09e-05 ] [ -2.9e-06 7e-07 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.826481347712e-14 -1.474002491136e-14 4.005441552e-15 ] [ 4.32587687616e-15 1.714328984256e-14 7.04957713152e-15 ] [ 1.345828361472e-14 -2.88391791744e-15 5.76783583488e-15 ] [ 4.96674752448e-15 -6.408706483200001e-16 -1.746372516672e-14 ] [ -4.646312200320001e-15 1.12152363456e-15 4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }