{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45404e-10 0.0 0.0 ] "source-value" [ 5.45404 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.69758e-13 5.32364e-10 0.0 ] "source-value" [ 0.00269758 5.32364 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.64471e-12 4.33477e-12 5.272210000000001e-10 ] "source-value" [ -0.0264471 0.0433477 5.27221 ] } "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" [ [ -2.870165794633025e-09 4.646204694268744e-09 5.18743197309964e-09 ] [ -2.276054510773411e-09 1.58228960349432e-09 -1.48883031532618e-09 ] [ 2.02633205286073e-10 -6.941021654577696e-10 -1.682273275297682e-09 ] [ 4.77180428632078e-09 -2.865500897183904e-09 -4.57898377196646e-09 ] [ -5.361365228359661e-10 2.333029834021004e-09 2.028685970752009e-09 ] [ 1.615887407450158e-09 -4.161938319095854e-09 -3.449961630385791e-09 ] [ -1.186588347566012e-09 2.583812772638994e-09 7.449323883415828e-09 ] [ 2.786202767514028e-10 -3.423795522685534e-09 -3.465392674073703e-09 ] ] "source-value" [ [ -1.7914166 2.8999329 3.2377404 ] [ -1.4206015 0.9875875 -0.9292548 ] [ 0.1264737 -0.4332245 -1.0499924 ] [ 2.978326 -1.788505 -2.8579769 ] [ -0.3346301 1.4561627 1.2662062 ] [ 1.0085576 -2.5976776 -2.1532967 ] [ -0.7406102 1.6126891 4.6495023 ] [ 0.1739011 -2.1369651 -2.162928 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.65045e-12 3.66931e-12 2.59636e-12 ] [ 1.48655e-10 1.36127e-10 1.37402e-10 ] [ -1.76096e-12 2.76119e-10 2.70854e-10 ] [ 1.17184e-10 4.14313e-10 4.05378e-10 ] [ 2.72197e-10 2.31604e-12 2.74475e-10 ] [ 4.08411e-10 1.50063e-10 4.06205e-10 ] [ 2.69936e-10 2.73466e-10 -1.81062e-11 ] [ 4.07246e-10 4.14715e-10 1.4277e-10 ] ] "source-value" [ [ 0.0265045 0.0366931 0.0259636 ] [ 1.48655 1.36127 1.37402 ] [ -0.0176096 2.76119 2.70854 ] [ 1.17184 4.14313 4.05378 ] [ 2.72197 0.0231604 2.74475 ] [ 4.08411 1.50063 4.06205 ] [ 2.69936 2.73466 -0.181062 ] [ 4.07246 4.14715 1.4277 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.680402172765026e-18 "source-value" -35.454282 } }