{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46441e-10 0.0 0.0 ] "source-value" [ 5.46441 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] "source-value" [ 0.239301 5.60761 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] "source-value" [ 0.167861 -0.733416 5.71653 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.754362190538441e-09 -2.530452120065587e-09 -1.944478932133665e-09 ] [ 5.890114915885428e-09 -2.773861681656993e-09 -1.25082313308245e-09 ] [ -2.236907568091432e-09 7.166704413601246e-09 3.465248317960168e-09 ] [ 3.725333013385536e-10 -1.028059379644335e-09 -3.061933678947481e-09 ] [ -5.054472622522297e-09 7.720210934271616e-09 6.704211778922691e-09 ] [ -3.50809660907152e-09 -3.209626805947363e-09 2.353590887031055e-09 ] [ 3.048755455806077e-09 8.8708514052144e-10 -2.408811506443547e-09 ] [ 6.242435156975969e-09 -6.232000340862362e-09 -3.857004053742094e-09 ] ] "source-value" [ [ -2.9674395 -1.579384 -1.2136483 ] [ 3.6763206 -1.7313083 -0.7807024 ] [ -1.3961679 4.4731051 2.1628379 ] [ 0.232517 -0.6416642 -1.9111087 ] [ -3.1547537 4.8185767 4.1844399 ] [ -2.1895817 -2.0032915 1.4689959 ] [ 1.9028835 0.553675 -1.5034619 ] [ 3.8962216 -3.8897087 -2.4073526 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.990371939189021e-18 "source-value" -31.147452 } }