{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46308e-10 0.0 0.0 ] "source-value" [ 5.46308 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] "source-value" [ -0.0404011 5.38219 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] "source-value" [ 0.0107061 -0.144189 5.56456 ] } "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" [ [ 1.10485635139148e-09 1.295936581500288e-10 9.167428717314067e-10 ] [ -4.159937520931799e-09 1.905482754271703e-09 3.222132595561017e-09 ] [ 2.855888638547414e-09 -5.581955148558674e-09 -8.663432017709012e-10 ] [ -9.17632880844261e-10 1.135838762231524e-09 -2.04501823878912e-11 ] [ -6.118417714336973e-10 8.587107527847341e-10 8.310746480348927e-10 ] [ -2.045035862731949e-09 2.998746396505722e-09 2.793703197146642e-09 ] [ 5.110116857433329e-09 -9.441553126249842e-10 -3.471603671961895e-09 ] [ -1.336413651212855e-09 -5.022615423247296e-10 -3.405256256353271e-09 ] ] "source-value" [ [ 0.6895971 0.080886 0.5721859 ] [ -2.5964288 1.1893088 2.011097 ] [ 1.7825055 -3.4839824 -0.5407289 ] [ -0.5727414 0.7089348 -0.012764 ] [ -0.3818816 0.5359651 0.518716 ] [ -1.276411 1.8716703 1.7436924 ] [ 3.1894841 -0.5892954 -2.1668046 ] [ -0.8341238 -0.313487 -2.1253938 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.768287648687066e-18 "source-value" -36.00282 } }