{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.6039531 13.0140701 14.9226372 ] [ 0.1435603 -1.348361 -0.9639175 ] [ -1.2176162 1.7302728 -0.5909743 ] [ 14.053148 -13.6172677 -14.1367294 ] [ -0.6315697 -0.0732659 -2.5059975 ] [ 2.3561885 -1.4550534 1.6470016 ] [ -0.8341757 2.357569 1.7049205 ] [ 0.7344179 -0.607964 -0.0769406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.339811242085186e-08 2.085083902745804e-08 2.390870063949918e-08 ] [ 2.300089582300302e-10 -2.160312488396874e-09 -1.544366095603695e-09 ] [ -1.950836224819871e-09 2.772202650605755e-09 -9.46845214754506e-10 ] [ 2.251562535974383e-08 -2.181726812786292e-08 -2.264953752586084e-08 ] [ -1.01188621608239e-09 -1.173849130489806e-10 -4.015050639362414e-09 ] [ 3.775030159999509e-09 -2.331252558702255e-09 2.638787479680614e-09 ] [ -1.336496815190594e-09 3.777241964842745e-09 2.731583787927597e-09 ] [ 1.176667198971348e-09 -9.740657151131759e-10 -1.232724315259404e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -32.940017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.277572556096277e-18 } }