{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3061507 -4.9461937 -4.6894876 ] [ -0.0736634 -3.6666108 8.5173813 ] [ -4.3387656 3.7109025 0.4791989 ] [ 4.5469988 -1.5232721 -8.9290339 ] [ -0.6966038 6.782878 0.5106849 ] [ 4.8681848 -0.3577039 4.1112564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.899213977181554e-09 -7.924675908088249e-09 -7.5133873962515e-09 ] [ -1.180217772886387e-10 -5.874558101332784e-09 1.364634918929911e-08 ] [ -6.951468807451285e-09 5.945521227568272e-09 7.677612742930771e-10 ] [ 7.285095172165655e-09 -2.44055094573692e-09 -1.430588936091065e-08 ] [ -1.116082322320439e-09 1.086736855333866e-08 8.18207407375586e-10 ] [ 7.799691872293924e-09 -5.731048257489812e-10 6.586958886194374e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.973694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.918397259141324e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0004905 1.9285975 2.5113733 ] [ 2.5450239 2.123285 4.9711687 ] [ 1.2689042 3.9692248 3.8096828 ] [ 4.0726791 3.0182086 1.9664059 ] [ 3.3410835 5.0588393 3.2647142 ] [ 4.6172048 3.2129078 4.426204 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0004905e-10 1.9285975e-10 2.5113733e-10 ] [ 2.5450239e-10 2.123285e-10 4.9711687e-10 ] [ 1.2689042e-10 3.9692248e-10 3.8096828e-10 ] [ 4.0726791e-10 3.0182086e-10 1.9664059e-10 ] [ 3.3410835e-10 5.0588393e-10 3.2647142e-10 ] [ 4.6172048e-10 3.2129078e-10 4.426204e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.29e-05 -2.2e-05 -2.17e-05 ] [ 2.6e-06 -5e-07 8.6e-06 ] [ -3.18e-05 4.4e-06 1.51e-05 ] [ -9.8e-06 -8.1e-06 6.5e-06 ] [ 2.45e-05 3.5e-05 -5.4e-06 ] [ 1.6e-06 -8.7e-06 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.066807840832e-14 -3.52478856576e-14 -3.476723267136e-14 ] [ 4.16565921408e-15 -8.010883104e-16 1.377871893888e-14 ] [ -5.094921654144e-14 7.04957713152e-15 2.419286697408e-14 ] [ -1.570133088384e-14 -1.297763062848e-14 1.04141480352e-14 ] [ 3.92533272096e-14 5.6076181728e-14 -8.65175375232e-15 ] [ 2.56348259328e-15 -1.393893660096e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.807034 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.532566031899071e-18 } }