{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3807348 -0.4054829 -2.4583823 ] [ 2.1547646 0.9571726 1.9420925 ] [ 0.7099927 1.0036486 -1.2008696 ] [ -1.1134238 -1.0957764 0.1627055 ] [ 0.1214534 2.045599 -0.8432012 ] [ -0.7287801 -1.2602357 2.1549327 ] [ -0.2957327 -0.6686904 -1.295892 ] [ 0.5324607 -0.5762348 1.5386144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.212181016084964e-09 -6.496552225141843e-10 -3.938762646048532e-09 ] [ 3.452313465447463e-09 1.53355956179035e-09 3.111575198931024e-09 ] [ 1.137533704878668e-09 1.608022322418651e-09 -1.924005197749448e-09 ] [ -1.783901581402295e-09 -1.755627329704389e-09 2.606829481755744e-10 ] [ 1.945897979966707e-10 3.277410893331859e-09 -1.350957249270505e-09 ] [ -1.167634437924286e-09 -2.019120175237522e-09 3.45258279133742e-09 ] [ -4.738160179460602e-10 -1.0713601254334e-09 -2.076247865481754e-09 ] [ 8.530960850348025e-10 -9.232299246513638e-10 2.46513202010622e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.187069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.797807592707644e-18 } }