{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46402e-10 0.0 0.0 ] "source-value" [ 5.46402 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] "source-value" [ 0.0122514 5.46447 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] "source-value" [ -0.0384841 0.0769758 5.42124 ] } "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" [ [ -3.284686858019898e-09 6.49558290828626e-10 -8.854666216991079e-10 ] [ 2.478242631394226e-09 5.349761464183517e-09 7.849111330597824e-11 ] [ 3.446253873249936e-09 -1.679399771528277e-09 4.206096549812371e-10 ] [ -1.088302822763036e-09 -5.731790065265242e-10 -4.364216161607434e-09 ] [ 4.233234217415482e-10 -1.540536880756272e-09 -1.804052316979759e-09 ] [ 2.806695888235357e-09 -4.02859460634718e-10 -1.756299763232139e-09 ] [ -2.789974451497054e-09 -3.001205897836312e-09 5.950092397685076e-09 ] [ -1.991551522123417e-09 1.197861262269961e-09 2.360841857763809e-09 ] ] "source-value" [ [ -2.0501403 0.4054224 -0.5526648 ] [ 1.5467974 3.3390585 0.0489903 ] [ 2.1509825 -1.0481989 0.2625239 ] [ -0.6792652 -0.3577502 -2.7239295 ] [ 0.2642177 -0.9615275 -1.1260009 ] [ 1.7518018 -0.2514451 -1.0961961 ] [ -1.7413651 -1.8732054 3.7137556 ] [ -1.2430287 0.7476462 1.4735216 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.751668270599508e-18 "source-value" -35.89909 } }