{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48581e-10 0.0 0.0 ] "source-value" [ 5.48581 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] "source-value" [ 0.00228581 5.44331 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] "source-value" [ -0.0206328 -0.0957916 5.42731 ] } "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" [ [ 1.143627904091205e-09 7.765793339786361e-10 1.605358543568909e-10 ] [ -2.472793308271561e-09 2.967466621684858e-09 -3.120822001080309e-09 ] [ 1.411996653734419e-10 3.056621341925894e-10 5.266822388142874e-10 ] [ 1.561595089171757e-10 -4.488496200994579e-10 -8.280176950424065e-10 ] [ -6.515507576742527e-11 -3.538657006589645e-10 5.904913420243447e-09 ] [ -1.043696303028019e-09 8.342658634282023e-10 -6.551857759915238e-10 ] [ -1.389617130259761e-09 -1.422997679065818e-09 -1.210372339066464e-09 ] [ 3.530274899162605e-09 -2.658261113677707e-09 -7.777335420162605e-10 ] ] "source-value" [ [ 0.7137964 0.4847027 0.1001986 ] [ -1.5433962 1.852147 -1.9478639 ] [ 0.0881299 0.1907793 0.3287292 ] [ 0.0974671 -0.2801499 -0.516808 ] [ -0.0406666 -0.2208656 3.6855571 ] [ -0.651424 0.5207078 -0.4089348 ] [ -0.8673308 -0.8881653 -0.755455 ] [ 2.2034243 -1.6591561 -0.4854231 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.97341392033788e-18 "source-value" -62.249154 } }