{ "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" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.684713 -10.9424778 0.342172 ] [ -1.9094602 -0.7792536 2.0187083 ] [ -5.8621426 0.681796 -4.3386368 ] [ -3.6681795 13.2528733 3.8070837 ] [ 8.2908405 -0.4385262 -7.8872429 ] [ 7.8336548 -1.7744116 6.0579156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.505737643757831e-09 -1.753178210478302e-08 5.482199786923776e-10 ] [ -3.059292490788092e-09 -1.248501899594235e-09 3.234327242474913e-09 ] [ -9.392187821515728e-09 1.092357611354957e-09 -6.951262447102525e-09 ] [ -5.877071435797833e-09 2.123344375968455e-08 6.099620497568762e-09 ] [ 1.328339081588178e-08 -7.02596425248265e-10 -1.263675617695079e-08 ] [ 1.25508985759777e-08 -2.842920781196321e-09 9.705850745099606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.0114325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.427023367417296e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.209751 1.3679039 3.1215648 ] [ 2.1167307 2.7098271 4.805645 ] [ 1.7490235 3.1195463 1.6722766 ] [ 1.4465424 4.5334773 3.5077053 ] [ 4.0010521 2.9299564 1.8460678 ] [ 4.2633783 2.637624 4.0814166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.209751e-10 1.3679039e-10 3.1215648e-10 ] [ 2.1167307e-10 2.7098271e-10 4.805645e-10 ] [ 1.7490235e-10 3.1195463e-10 1.6722766e-10 ] [ 1.4465424e-10 4.533477300000001e-10 3.5077053e-10 ] [ 4.0010521e-10 2.9299564e-10 1.8460678e-10 ] [ 4.263378300000001e-10 2.637624e-10 4.0814166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.92e-05 -8.7e-06 -1.51e-05 ] [ 4.72e-05 5e-06 6.7e-06 ] [ -1.97e-05 2.08e-05 -2.07e-05 ] [ -1.78e-05 2.2e-05 1.35e-05 ] [ 5.9e-06 -4.08e-05 1.74e-05 ] [ -5.48e-05 1.6e-06 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.280532353535999e-14 -1.393893660096e-14 -2.419286697408e-14 ] [ 7.562273650176e-14 8.010883104e-15 1.073458335936e-14 ] [ -3.156287942976e-14 3.332527371264e-14 -3.316505605055999e-14 ] [ -2.851874385024e-14 3.52478856576e-14 2.16293843808e-14 ] [ 9.45284206272e-15 -6.536880612864e-14 2.787787320192e-14 ] [ -8.779927881984e-14 2.56348259328e-15 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }