{ "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" [ 5.44188 0 0 ] "si-unit" "m" "si-value" [ 5.44188e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0681259 5.43851 0 ] "si-unit" "m" "si-value" [ -6.812590000000001e-12 5.43851e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00252152 -0.017859 5.5414 ] "si-unit" "m" "si-value" [ -2.52152e-13 -1.7859e-12 5.5414e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00431502 -0.0137584 0.0307734 ] [ 1.33409 1.32426 1.37744 ] [ 0.0396224 2.60036 2.83022 ] [ 1.35045 4.04355 3.98016 ] [ 2.67673 0.013858 2.80413 ] [ 4.08887 1.41719 3.918 ] [ 2.72143 2.70354 0.017408 ] [ 3.9766 4.07774 1.36794 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.31502e-13 -1.37584e-12 3.07734e-12 ] [ 1.33409e-10 1.32426e-10 1.37744e-10 ] [ 3.962240000000001e-12 2.60036e-10 2.83022e-10 ] [ 1.35045e-10 4.04355e-10 3.98016e-10 ] [ 2.67673e-10 1.3858e-12 2.80413e-10 ] [ 4.08887e-10 1.41719e-10 3.918e-10 ] [ 2.72143e-10 2.70354e-10 1.7408e-12 ] [ 3.9766e-10 4.077740000000001e-10 1.36794e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2993083 -0.288379 -2.2258351 ] [ 0.6348157 0.5046236 -0.0466766 ] [ 2.7063206 4.0988054 -4.8284951 ] [ -1.0236732 -0.7560345 3.9514636 ] [ 1.5229004 0.6404759 -2.3648452 ] [ -4.008385 -3.7819209 6.3183769 ] [ -0.6955433 -0.6711605 -2.1453333 ] [ 1.1628732 0.2535899 1.3413448 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.795447646222622e-10 -4.62034095536286e-10 -3.566180988357053e-09 ] [ 1.017086881436354e-09 8.084961408849623e-10 -7.478415787456439e-11 ] [ 4.336003629432861e-09 6.567010239193023e-09 -7.736102026603492e-09 ] [ -1.640105281892008e-09 -1.211300810397873e-09 6.330942650021522e-09 ] [ 2.439955436789253e-09 1.02615552162012e-09 -3.788899722467056e-09 ] [ -6.422140787076089e-09 -6.05930529761625e-09 1.012315583398535e-08 ] [ -1.114383223195252e-09 -1.075317670763757e-09 -3.437202885402112e-09 ] [ 1.863128269344809e-09 4.062958123983965e-10 2.149071296697403e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.238993 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.645909119028956e-18 } }