{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7377811 0.41834869999999996 -2.3466425 ] [ 1.9726765 -0.8278495 -0.5860912 ] [ -0.7250104 3.4295075 3.1498476 ] [ 2.0965558 2.0076532 -3.3856661 ] [ -1.8632132 2.3225604 4.2606918 ] [ -1.734869 -2.3897171 3.7613489 ] [ 1.5142234 -1.7307685 -2.8826002 ] [ 2.4774182 -3.2297346 -1.9708883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.988585492088107e-09 6.702685064820729e-10 -3.759735750875665e-09 ] [ 3.160576168701571e-09 -1.32636111444097e-09 -9.39021618296617e-10 ] [ -1.161594712716857e-09 5.494676737358256e-09 5.046612183802991e-09 ] [ 3.359052686962641e-09 3.216615019714306e-09 -5.424435071255116e-09 ] [ -2.985196628605955e-09 3.721151973275896e-09 6.826380790394269e-09 ] [ -2.779566551950675e-09 -3.828748867945975e-09 6.026345270251797e-09 ] [ 2.426053330148287e-09 -2.772996826717085e-09 -4.618434647553404e-09 ] [ 3.969261519984419e-09 -5.174605267508839e-09 -3.157711156468257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 596.97943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.564664858445102e-17 } }