{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.52208e-10 0.0 0.0 ] "source-value" [ 5.52208 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] "source-value" [ -0.0968577 5.45697 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] "source-value" [ 0.137264 0.147448 5.57607 ] } "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" [ [ 4.929444046217913e-10 5.950972633520543e-10 -1.48571456245171e-09 ] [ -3.62882910898489e-10 -1.377244161087971e-09 1.426690215523776e-10 ] [ -6.009887872220601e-10 1.100893687955255e-09 1.077973269653414e-10 ] [ -1.961086934767215e-09 9.827977298890732e-10 -8.788733444691916e-10 ] [ 3.084975061584192e-10 -1.405065637672838e-10 -4.345852814268135e-10 ] [ 1.005936044211343e-09 -1.248801506622325e-09 6.028958580537983e-11 ] [ 7.648773563756372e-10 -1.37490786713952e-11 1.264958816972444e-09 ] [ 3.527033215205741e-10 1.015124687349293e-10 1.223458757487496e-09 ] ] "source-value" [ [ 0.3076717 0.3714305 -0.9273101 ] [ -0.2264937 -0.8596082 0.089047 ] [ -0.3751077 0.6871238 0.0672818 ] [ -1.2240142 0.6134141 -0.5485496 ] [ 0.192549 -0.0876973 -0.2712468 ] [ 0.6278559 -0.7794406 0.0376298 ] [ 0.4773989 -0.0085815 0.7895252 ] [ 0.2201401 0.0633591 0.7636229 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.937349725691983e-17 "source-value" 620.24059 } }