{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40534e-10 0.0 0.0 ] "source-value" [ 5.40534 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] "source-value" [ 0.0241155 5.39517 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] "source-value" [ -0.0520891 0.00914509 5.32386 ] } "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" [ [ 3.87714886126606e-09 3.376524743447789e-10 4.986580868868883e-09 ] [ -1.362665635579987e-09 -9.83878237802141e-10 -4.922942413490707e-10 ] [ 4.181752757800611e-09 3.648633934629923e-09 1.599539438082163e-09 ] [ -3.431161209264338e-09 7.913020553824915e-10 -7.336212617252279e-09 ] [ 5.153627007706733e-10 3.051808403357012e-10 -6.757550001023406e-10 ] [ -4.965639298911393e-09 1.054959925107567e-09 -2.139584791219895e-09 ] [ 6.810547760592199e-09 -4.286969458882831e-09 3.087857697760336e-09 ] [ -5.625345616238504e-09 -8.668818535508141e-10 9.698688054298655e-10 ] ] "source-value" [ [ 2.419926 0.2107461 3.112379 ] [ -0.850509 -0.6140885 -0.3072659 ] [ 2.6100448 2.2772982 0.998354 ] [ -2.1415624 0.4938919 -4.5789038 ] [ 0.3216641 0.1904789 -0.4217731 ] [ -3.0993083 0.6584542 -1.3354238 ] [ 4.2508096 -2.6757159 1.9272892 ] [ -3.5110646 -0.5410651 0.6053445 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.688917581286916e-18 "source-value" -35.507431 } }