{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] "source-value" [ 5.41852 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] "source-value" [ 0.038783 5.47951 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] "source-value" [ 0.00323821 0.0198894 5.39896 ] } "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" [ [ 8.772846261320064e-11 -7.957883101383935e-11 3.513800838494553e-10 ] [ -2.190071299153248e-10 -1.023792462867821e-10 -2.446970707238804e-10 ] [ 3.485471151485568e-11 5.300432849294016e-11 -3.259444084706208e-10 ] [ 3.018390203400365e-10 1.377380025665414e-10 -1.552584447856378e-10 ] [ -1.114272183174259e-10 -3.294400374218823e-10 -1.087200204812602e-10 ] [ -7.021539040656e-11 2.51123080714585e-10 4.85277188402953e-10 ] [ -1.430657204836877e-10 -8.882803642805569e-11 3.046330561490496e-11 ] [ 1.192932646549056e-10 1.583605791588307e-10 -3.250047318825216e-11 ] ] "source-value" [ [ 0.0547558 -0.0496692 0.2193142 ] [ -0.1366935 -0.0639001 -0.1527279 ] [ 0.0217546 0.0330827 -0.2034385 ] [ 0.1883931 0.0859693 -0.0969047 ] [ -0.0695474 -0.2056203 -0.0678577 ] [ -0.043825 0.1567387 0.3028862 ] [ -0.0892946 -0.0554421 0.0190137 ] [ 0.074457 0.0988409 -0.0202852 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.890180625295603e-18 "source-value" 30.522107 } }