{ "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" [ [ -5.300218157626829e-10 1.250228084685485e-10 8.316922871222112e-10 ] [ -1.990510587972883e-10 2.792936715851251e-10 9.278172767520384e-11 ] [ 3.12248201627712e-10 -3.082459644289536e-11 1.918965390971059e-10 ] [ 6.502382545864934e-10 -4.350207530323469e-10 -4.757450385975033e-10 ] [ -4.452221320123046e-10 1.297896043507527e-10 5.272836959177357e-10 ] [ -3.243779603884646e-10 1.98367570250855e-10 1.543295027808979e-10 ] [ 2.058925131857664e-11 -1.11377230406857e-10 -4.501420959794573e-10 ] [ 5.155974196456206e-10 -1.552512349908442e-10 -8.720962975808697e-10 ] ] "source-value" [ [ -0.3308136 0.0780331 0.5191015 ] [ -0.1242379 0.1743214 0.0579098 ] [ 0.19489 -0.0192392 0.1197724 ] [ 0.4058468 -0.2715186 -0.2969367 ] [ -0.2778858 0.0810083 0.3291046 ] [ -0.2024608 0.1238113 0.0963249 ] [ 0.0128508 -0.0695162 -0.2809566 ] [ 0.3218106 -0.0969002 -0.5443197 ] ] } "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" 4.98038525187625e-18 "source-value" 31.08512 } }