{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0259194 -0.1041245 2.1852466 ] [ -0.8631167 1.0125239 -1.1726959 ] [ -0.0971805 -0.2881767 -2.0827345 ] [ 1.8619284 1.4488298 0.617467 ] [ -2.4121759 -4.105844 -1.8529065 ] [ 0.4389882 2.1351425 2.5920605 ] [ -0.2963076 -1.7176041 -1.0018735 ] [ 1.3419448 1.6192532 0.7154361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.152745670516352e-11 -1.668258395524896e-10 3.50115101320269e-09 ] [ -1.382865397762047e-09 1.622242120581237e-09 -1.878865954288015e-09 ] [ -1.557003250976544e-10 -4.617099713992953e-10 -3.336908523233578e-09 ] [ 2.983138152083551e-09 2.32128123307834e-09 9.892911915155137e-10 ] [ -3.864731832237199e-09 -6.578287265451956e-09 -2.968683474828355e-09 ] [ 7.033366308470746e-10 3.420875395576464e-09 4.152938732799158e-09 ] [ -4.74737109285358e-10 -2.751905132810225e-09 -1.605178298699069e-09 ] [ 2.150032584964132e-09 2.594329620195586e-09 1.146254993096331e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.144057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.790916310626258e-18 } }