{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39006e-10 0.0 0.0 ] "source-value" [ 5.39006 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] "source-value" [ 0.23331 5.36322 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] "source-value" [ -0.160148 -0.0213292 5.4933 ] } "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" [ [ -4.250627126375563e-09 1.972530641498941e-09 3.606306831573318e-09 ] [ 7.491611252492236e-10 -4.789378561674337e-10 -1.35140281458875e-09 ] [ 7.954374334584384e-11 -4.605016097918881e-10 2.732658024846893e-10 ] [ 4.457472133562395e-09 -4.343730090463237e-09 -3.698693782929157e-09 ] [ -3.995703362281116e-09 2.810980909607687e-09 4.297977053138375e-09 ] [ 2.083866215313658e-10 9.595035237816001e-10 3.434614861188134e-10 ] [ -9.35564762019579e-10 9.050839926795072e-10 -2.387733431037965e-10 ] [ 3.687331787205092e-09 -1.36492967136284e-09 -3.232141232693493e-09 ] ] "source-value" [ [ -2.6530328 1.2311568 2.2508797 ] [ 0.4675896 -0.2989295 -0.8434793 ] [ 0.0496473 -0.2874225 0.1705591 ] [ 2.7821353 -2.7111431 -2.3085431 ] [ -2.4939219 1.7544763 2.6825863 ] [ 0.1300647 0.598875 0.2143718 ] [ -0.5839336 0.564909 -0.1490306 ] [ 2.3014515 -0.8519221 -2.0173439 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.794326223128308e-18 "source-value" -36.16534 } }