{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42446e-10 0.0 0.0 ] "source-value" [ 5.42446 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] "source-value" [ -0.00225581 5.46076 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] "source-value" [ -0.0117255 0.0343157 5.56103 ] } "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" [ [ -1.616701473391187e-09 2.554814817761472e-11 4.598618606672026e-10 ] [ -9.270850820363328e-10 1.589198829953858e-09 -3.576893752733347e-09 ] [ -2.110101697261596e-09 9.085110484713984e-10 2.303606341032999e-10 ] [ 3.633660152149588e-09 8.882739555740737e-10 3.424109389085549e-10 ] [ 9.808589359602431e-10 -3.85009819185346e-09 2.742398457613047e-09 ] [ -1.586191704654279e-10 1.033397511709517e-09 1.943840304532614e-09 ] [ -7.557249224293172e-10 -5.928716798081012e-10 -1.964825613911852e-09 ] [ 9.53713257474029e-10 -1.95962222490048e-12 -1.771529893971801e-10 ] ] "source-value" [ [ -1.0090657 0.0159459 0.2870232 ] [ -0.578641 0.9918999 -2.2325215 ] [ -1.3170219 0.567048 0.1437798 ] [ 2.2679523 0.554417 0.2137161 ] [ 0.612204 -2.4030423 1.7116705 ] [ -0.0990023 0.644996 1.2132497 ] [ -0.4716864 -0.3700414 -1.2263477 ] [ 0.595261 -0.0012231 -0.1105702 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.814860519788791e-18 "source-value" -36.293505 } }