{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.23298e-10 0.0 0.0 ] "source-value" [ 5.23298 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] "source-value" [ -0.924429 5.53043 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] "source-value" [ -0.629107 -0.473789 5.46851 ] } "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" [ [ 1.064487428600817e-09 1.566416038623744e-10 -4.943921314163463e-10 ] [ -1.496134173909187e-08 -7.774732684242116e-09 5.670620884495044e-09 ] [ 2.360603293664972e-09 -2.872448415664679e-09 -4.748606210810555e-09 ] [ 2.063773318312205e-09 5.701672349147444e-09 3.931840441958366e-09 ] [ 2.418981162326413e-09 -5.85356846607667e-09 6.316747313001915e-09 ] [ -1.5439020925306e-09 -3.323668776509935e-09 4.009657679777635e-09 ] [ 5.288966231436612e-09 6.274835013472436e-09 -1.614769488712995e-08 ] [ 3.308432237063789e-09 7.691269376011146e-09 1.461826910123893e-09 ] ] "source-value" [ [ 0.6644008 0.097768 -0.3085753 ] [ -9.3381351 -4.8526065 3.5393232 ] [ 1.4733727 -1.7928413 -2.9638469 ] [ 1.288106 3.558704 2.4540618 ] [ 1.5098093 -3.6535101 3.9426036 ] [ -0.9636279 -2.0744709 2.5026315 ] [ 3.3011131 3.916444 -10.0785985 ] [ 2.064961 4.8005128 0.9124006 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.822091323264845e-18 "source-value" -30.097127 } }