{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0244374 8.5846282 9.3307895 ] [ -12.0771841 -12.6966134 -0.5470077 ] [ -3.1303977 -4.4002939 -4.8857659 ] [ 5.751649 -0.1746015 1.3935661 ] [ 4.4890596 0.9336754 -1.9234689 ] [ -3.2326666 1.6575798 2.3387468 ] [ 10.3510159 5.5351167 -4.6474785 ] [ -2.1270386 0.5605086 -1.0593814 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.915303095313792e-11 1.375409060030039e-08 1.494957279050612e-08 ] [ -1.934978201011749e-08 -2.0342217152816e-08 -8.764029483375802e-10 ] [ -5.015450008746093e-09 -7.050048011228854e-09 -7.82785989968187e-09 ] [ 9.215157558847699e-09 -2.797424412566112e-10 2.232739024959435e-09 ] [ 7.1922663404978e-09 1.495912897296088e-09 -3.081736902415893e-09 ] [ -5.179302849361025e-09 2.65573560267034e-09 3.747085444930813e-09 ] [ 1.658415567650907e-08 8.868234570139648e-09 -7.446081398370653e-09 ] [ -3.407891516459163e-09 8.98033774677339e-10 -1.697316111590373e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.87768 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.383667106774374e-18 } }