{ "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" [ [ 0.5237828 -0.0071132 0.4790038 ] [ -2.3219994 0.4175479 1.7445803 ] [ 1.5657145 -3.1473181 -0.0254926 ] [ -0.3671193 0.7150043 0.1096721 ] [ -0.8290497 0.567505 0.6228826 ] [ -0.7925569 1.5154899 1.3190284 ] [ 2.8338145 0.0971369 -1.8442738 ] [ -0.6125865 -0.1582526 -2.4054007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.391925565371622e-10 -1.139660273907456e-11 7.67448689634359e-10 ] [ -3.720253152191628e-09 6.689854834441364e-10 2.79512576976825e-09 ] [ 2.508551166747561e-09 -5.042559478040676e-09 -4.084364772340608e-11 ] [ -5.881899595044614e-10 1.145563173231469e-09 1.757140745740397e-10 ] [ -1.328284046821254e-09 9.092432431871041e-10 9.979679392231181e-10 ] [ -1.269816135833724e-09 2.42808248683853e-09 2.113316464651231e-09 ] [ 4.540271339584042e-09 1.556304701969875e-10 -2.954852364713975e-09 ] [ -9.814717685176993e-10 -2.535486159008141e-10 -3.853876765195954e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.086761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.781736479459723e-18 } }