{ "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" [ [ -3.152463 2.7748061 2.0146726 ] [ 0.1037632 -0.5052524 -0.3819644 ] [ -0.4086838 0.7924124 -0.9927296 ] [ 1.4689717 -1.5822096 -0.9212694 ] [ 0.3203642 0.0039122 -1.3973183 ] [ 1.4798424 -0.3641157 0.3211795 ] [ 0.0939635 0.1196528 1.0723291 ] [ 0.0942418 -1.2392058 0.2851006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.05080251653703e-09 4.445729460673227e-09 3.22786133828635e-09 ] [ 1.662469731393946e-10 -8.095035828830899e-10 -6.119744316578995e-10 ] [ -6.54783629659703e-10 1.269584621312018e-09 -1.590528155896136e-09 ] [ 2.353552114356832e-09 -2.53497923032532e-09 -1.476036294138444e-09 ] [ 5.132800313812954e-10 6.26803537589376e-12 -2.238750712076001e-09 ] [ 2.370968895748562e-09 -5.833776618062265e-10 5.145862859802336e-10 ] [ 1.505461229085408e-10 1.917049187732582e-10 1.718060613823505e-09 ] [ 1.509920086621094e-10 -1.98542656111976e-09 4.567815158960525e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 155.41803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.49007134116793e-17 } }