{ "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" [ [ -0.1068921 -0.446992 1.8370788 ] [ -0.5911082 1.1321926 -0.9079745 ] [ 0.0286469 -0.4026966 -1.7462328 ] [ 1.4199647 1.3861015 0.4832818 ] [ -1.6649703 -3.1094324 -1.030189 ] [ -0.0986471 1.5806218 1.7456911 ] [ -0.1322285 -1.5962678 -0.6838793 ] [ 1.1452346 1.456473 0.302224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.712600235682157e-10 -7.161601320846337e-10 2.94332470392732e-09 ] [ -9.470597384031705e-10 1.813972513962766e-09 -1.45473551618257e-09 ] [ 4.589739343839552e-11 -6.451910777956493e-10 -2.797773366634123e-09 ] [ 2.275034244701286e-09 2.220779417355811e-09 7.743028012181415e-10 ] [ -2.667576488986362e-09 -4.981859895238034e-09 -1.650544730805331e-09 ] [ -1.580500773297197e-10 2.532435294286814e-09 2.796905467558635e-09 ] [ -2.118534113034528e-10 -2.55750294969585e-09 -1.095695425909069e-09 ] [ 1.83486810145124e-09 2.333526989426438e-09 4.842162270446592e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.953496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.439949748562632e-18 } }