{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4238e-10 0.0 0.0 ] "source-value" [ 5.4238 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] "source-value" [ -0.0012341 5.50722 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] "source-value" [ -0.00966142 -0.113973 5.43239 ] } "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" [ [ 3.401627646742483e-10 -7.183982126062291e-10 1.57666195811376e-10 ] [ -1.25572210853587e-09 6.996122110743629e-10 -7.872531948440678e-10 ] [ 2.453302829679529e-09 3.431605973494272e-10 3.098867695280811e-09 ] [ -5.068096410981945e-10 1.034290244522627e-09 -2.620062819772904e-09 ] [ 4.348156744248845e-10 -5.462661883903768e-09 2.928583397274663e-10 ] [ 4.810017800903481e-10 1.031023085957491e-09 1.828512907667174e-10 ] [ -5.378077532691226e-10 -1.25152104121847e-10 -7.54745191425698e-10 ] [ -1.408943385748161e-09 3.198125901510275e-09 4.298176844562988e-10 ] ] "source-value" [ [ 0.2123129 -0.4483889 0.0984075 ] [ -0.7837601 0.4366636 -0.4913648 ] [ 1.5312312 0.214184 1.9341611 ] [ -0.3163257 0.6455532 -1.6353146 ] [ 0.2713906 -3.4095254 0.1827878 ] [ 0.3002177 0.643514 0.1141268 ] [ -0.3356732 -0.0781138 -0.4710749 ] [ -0.8793933 1.9961132 0.2682711 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.83075667534972e-18 "source-value" -36.392721 } }