{ "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" [ [ -4.2430812 4.6488751 3.5620405 ] [ 0.3291796 -0.7186415 -0.2664416 ] [ -1.2637169 1.0983651 -1.0439629 ] [ 3.4254128 -4.4842169 -3.0974214 ] [ 0.0523055 0.5971351 -2.0788571 ] [ 1.4334704 -1.0312431 1.2265239 ] [ -0.0222489 1.2126075 1.269533 ] [ 0.2886787 -1.3228814 0.4285855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.79816555480468e-09 7.448319059604411e-09 5.707018058461677e-09 ] [ 5.274038635094664e-10 -1.151390619522711e-09 -4.268865058455743e-10 ] [ -2.024697689170914e-09 1.759774898821073e-09 -1.672612965142878e-09 ] [ 5.488116349964515e-09 -7.184507538967913e-09 -4.962616192731568e-09 ] [ 8.380264992968699e-11 9.567159045612533e-10 -3.330696271045001e-09 ] [ 2.296672780410633e-09 -1.652233598793725e-09 1.965107933622552e-09 ] [ -3.564666771220259e-11 1.942811402713155e-09 2.034016108691922e-09 ] [ 4.625142678734957e-10 -2.119489668633207e-09 6.86669673771207e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -24.80975307419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.974960667077714e-18 } }