{ "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" [ [ 3.0089239 2.7273366 -2.1251806 ] [ -2.9564291 2.3046898 -4.9027312 ] [ -0.0022184 -0.3076877 0.7442639 ] [ -0.5769183 -1.7899283 3.4358648 ] [ 2.3856317 -0.147377 -0.2781656 ] [ -0.2894673 -0.2660701 1.789887 ] [ -1.6732334 -2.0547664 -2.3260863 ] [ 0.1037109 -0.4661969 3.662148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.820827566064153e-09 4.369674973573004e-09 -3.4049147003501e-09 ] [ -4.736721624097649e-09 3.692520146178132e-09 -7.855041371422779e-09 ] [ -3.5542686448656e-12 -4.929700435092017e-10 1.192442230109712e-09 ] [ -9.243250199870021e-10 -2.867781298795342e-09 5.504862300143083e-09 ] [ 3.822203367069697e-09 -2.36123985789018e-10 -4.456704247025904e-10 ] [ -4.637777443670681e-10 -4.262912972260433e-10 2.867715128900357e-09 ] [ -2.680815456708375e-09 -3.292098714408297e-09 -3.726801118527513e-09 ] [ 1.661631806711106e-10 -7.469297800232345e-10 5.867407955849831e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.728984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.763108351735985e-18 } }