{ "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" [ [ -8.3201563 9.6920448 0.9617562 ] [ 0.2062268 -0.7582411 -0.4946286 ] [ -5.2070303 4.3846098 -4.6908937 ] [ 4.0760224 -5.7536075 -4.1790792 ] [ -0.061892 0.8117647 -2.2972089 ] [ 5.1520877 -5.153122 5.2681327 ] [ 0.04168 1.3550449 1.505609 ] [ 4.1130617 -4.5784937 3.9263124 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.333036001508789e-08 1.55283677142412e-08 1.540903311244631e-09 ] [ 3.304117602645912e-10 -1.214836173358457e-09 -7.924823854281324e-10 ] [ -8.342582279190008e-09 7.024919370767412e-09 -7.515640278717806e-09 ] [ 6.530507848940601e-09 -9.218295497707153e-09 -6.695623045875413e-09 ] [ -9.9161916231528e-11 1.30059043464602e-09 -3.680534422996842e-09 ] [ 8.254554529258801e-09 -8.256211660551346e-09 8.440479116751331e-09 ] [ 6.677872210512e-11 2.171021276800867e-09 2.412251559740106e-09 ] [ 6.589851349940318e-09 -7.335555625056205e-09 6.290645985064461e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.463897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.36150738559827e-18 } }