{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5421628 0.1639002 0.4619563 ] [ -1.5128344 -0.3559535 1.0067915 ] [ 0.8389675 -2.2924377 0.8073441 ] [ -0.3794835 0.6223062 0.0290615 ] [ -0.7291981 0.7292699 0.6285664 ] [ -0.1128332 0.7346519 0.416113 ] [ 1.9135232 0.7026363 -1.01734 ] [ -0.5603043 -0.3043733 -2.3324928 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.686405628274662e-10 2.625970685844441e-10 7.40135583691271e-10 ] [ -2.423827906821996e-09 -5.703003757919328e-10 1.613057803320163e-09 ] [ 1.344174114111024e-09 -3.672890087580524e-09 1.293507841960817e-09 ] [ -6.079995916793569e-10 9.970444446188889e-10 4.65616558653792e-11 ] [ -1.16830414775178e-09 1.168419184033154e-09 1.007074390700421e-09 ] [ -1.807787150900506e-10 1.177042098606299e-09 6.666865202109504e-10 ] [ 3.065802134398402e-09 1.125747452785415e-09 -1.629958363404672e-09 ] [ -8.977064499937094e-10 -4.876597852557447e-10 -3.73706543234433e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.564257 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.537804448072274e-18 } }