{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] "source-value" [ 5.37283 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] "source-value" [ -0.256601 5.36059 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] "source-value" [ 0.0433697 -0.246629 5.47376 ] } "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" [ [ 4.023393460383077e-09 5.343120121654977e-09 -6.932794317412225e-09 ] [ 6.392973108783744e-10 9.89209961160839e-10 8.285013921642259e-10 ] [ 1.254623175591663e-09 3.014129214677347e-09 -2.560237704969894e-09 ] [ -1.653220045326743e-09 -2.48814103877519e-09 2.032337010835488e-09 ] [ 2.136127614507533e-09 1.39257266547215e-09 8.931919969292814e-10 ] [ -5.827792488383578e-10 -4.464432309238474e-09 -3.688542231642106e-10 ] [ -1.842447838826582e-09 1.72330581964468e-09 1.214907940862287e-09 ] [ -3.974994428368966e-09 -5.509764274378667e-09 4.892947744537386e-09 ] ] "source-value" [ [ 2.5112047 3.3349133 -4.3271099 ] [ 0.399018 0.6174163 0.5171099 ] [ 0.7830742 1.8812715 -1.5979747 ] [ -1.0318588 -1.5529755 1.268485 ] [ 1.333266 0.8691755 0.5574866 ] [ -0.3637422 -2.7864795 -0.2302207 ] [ -1.1499655 1.0756029 0.7582859 ] [ -2.4809964 -3.4389244 3.0539378 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.728048502202688e-18 "source-value" -35.751667 } }