{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 27.6223888 26.6530708 -28.4886508 ] [ -5.5562569 -0.8967987 -53.4669641 ] [ 55.8090079 95.3791977 -74.7871931 ] [ -0.138254 1.6095881 -0.8431683 ] [ 32.4891282 -22.5713662 34.5812996 ] [ -87.2585452 -66.2436105 96.6753477 ] [ -6.4072826 -6.2930228 -4.5371379 ] [ -16.5601861 -27.6370585 30.8664669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.42559459106233e-08 4.270292726010768e-08 -4.56438506459454e-08 ] [ -8.902104977681274e-09 -1.436829922541575e-09 -8.566352057193683e-08 ] [ 8.941588842410139e-08 1.528143219246065e-07 -1.19822293307266e-07 ] [ -2.215073283570359e-10 2.578844444184455e-09 -1.350904548789502e-09 ] [ 5.205332206107047e-08 -3.616331552309737e-08 5.540535019247354e-08 ] [ -1.398036022362729e-07 -1.06133964894897e-07 1.548909831687656e-07 ] [ -1.026559846915477e-08 -1.008253408738925e-08 -7.269296328615829e-09 ] [ -2.653234322411158e-08 -4.427944936119108e-08 4.945353204131441e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.0004819 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.613831892919923e-19 } }