{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7574282 1.7010917 -1.6202187 ] [ -2.8610846 2.6128099 -2.762811 ] [ 0.2041312 -0.6424007 -0.5259324 ] [ -0.6382599 -0.908952 2.7728468 ] [ 2.8371795 -0.963349 -1.0359731 ] [ -0.5622105 -0.0032759 0.8091475 ] [ -0.4998717 -1.9822848 -1.7958499 ] [ -0.2373123 0.186361 4.1587907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.815710374774627e-09 2.725449351576928e-09 -2.595876521722969e-09 ] [ -4.583962856250919e-09 4.186182936374786e-09 -4.426511191889069e-09 ] [ 3.27054236215849e-10 -1.029239382725555e-09 -8.426365954012339e-10 ] [ -1.022605089774146e-09 -1.456301643829402e-09 4.442590316020094e-09 ] [ 4.545662663913034e-09 -1.543455245471059e-09 -1.659811880597701e-09 ] [ -9.007605190682784e-10 -5.24857039207872e-12 1.296397207278768e-09 ] [ -8.008827511395513e-10 -3.175970362327204e-09 -2.877268724246018e-09 ] [ -3.802162188882759e-10 2.985832372289088e-10 6.663117230340467e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -31.698556 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.078668533631957e-18 } }