{ "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" [ [ 1.1548506 -0.2512976 0.66937 ] [ -3.707699 -0.0646795 2.6506843 ] [ 2.5058003 -4.7420031 0.516902 ] [ -0.9136862 1.3910015 0.104718 ] [ -0.998124 0.8155745 1.1066415 ] [ -1.1151559 2.0068111 1.5001033 ] [ 4.5553863 0.683744 -2.6274733 ] [ -1.4813721 0.1608491 -3.9209459 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.85027464708088e-09 -4.026231429002784e-10 1.07244897350058e-09 ] [ -5.940388703705165e-09 -1.03627983598803e-10 4.246864449570646e-09 ] [ 4.014734690130191e-09 -7.597526565175565e-09 8.281683064678678e-10 ] [ -1.463886680448251e-09 2.228630101158951e-09 1.67776732759212e-10 ] [ -1.599170950634616e-09 1.306694407186233e-09 1.773035153514711e-09 ] [ -1.78667672624724e-09 3.215265853271838e-09 2.403430455846292e-09 ] [ 7.298533488703714e-09 1.095478660437696e-09 -4.209676327718872e-09 ] [ -2.373419764879511e-09 2.577086696199294e-10 -6.2820479041581e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.539518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.694058532322241e-18 } }