{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.5612e-10 0.0 0.0 ] "source-value" [ 5.5612 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] "source-value" [ -0.0917257 5.43287 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] "source-value" [ -0.0143429 0.0662566 5.45634 ] } "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" [ [ -1.172434238644879e-09 -1.955265906668525e-10 5.353685995816166e-10 ] [ 2.001219216070986e-09 1.578884497522134e-09 -3.232076184322689e-09 ] [ -3.783811819174088e-09 8.739676398739642e-10 -1.912735807834065e-09 ] [ 8.467780617483398e-10 2.194118557515051e-09 2.389133733404544e-10 ] [ -5.865136021061185e-11 3.23241216076007e-10 2.60167832370221e-09 ] [ -6.977296535449229e-10 -4.582914071434943e-10 -5.740602036679641e-10 ] [ 1.169731366685589e-09 -2.816748905660229e-09 2.720540763063783e-09 ] [ 1.694898587287248e-09 -1.499644847298918e-09 -3.77629024081008e-10 ] ] "source-value" [ [ -0.7317758999999999 -0.12203809999999998 0.33415079999999997 ] [ 1.2490627999999997 0.9854621999999998 -2.0173032999999996 ] [ -2.3616695999999995 0.5454876999999999 -1.1938357999999998 ] [ 0.5285172999999999 1.3694610999999999 0.14911799999999997 ] [ -0.036607299999999995 0.20175129999999997 1.6238398999999997 ] [ -0.43548859999999995 -0.28604299999999994 -0.35830019999999996 ] [ 0.7300888999999999 -1.7580763999999998 1.6980279999999999 ] [ 1.0578724999999998 -0.9360046999999999 -0.23569749999999998 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.26295058828977e-18 "source-value" -26.607245 } }