{ "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" [ [ -0.11344 -0.4746715 1.8625327 ] [ -0.4893843 1.3371166 -0.9123902 ] [ 0.0187523 -0.4661734 -1.8684361 ] [ 1.3954811 1.4671708 0.7959958 ] [ -1.9300449 -3.3662707 -1.3565535 ] [ 0.0863718 1.6615788 1.8150109 ] [ -0.1387625 -1.6622267 -0.6914616 ] [ 1.1710267 1.5034761 0.3553021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.81750915863552e-10 -7.605075798600673e-10 2.9841063474155e-09 ] [ -7.840800840465734e-10 2.142296955803585e-09 -1.461810247487036e-09 ] [ 3.004449664622784e-11 -7.468921227188467e-10 -2.993564636878731e-09 ] [ 2.235807193188267e-09 2.350666754480433e-09 1.275325861014993e-09 ] [ -3.092272815874274e-09 -5.39336021482405e-09 -2.173438302564413e-09 ] [ 1.383828786564134e-10 2.662142706976919e-09 2.907968030477167e-09 ] [ -2.2232203334376e-10 -2.663180757209536e-09 -1.107843609700961e-09 ] [ 1.876191601072575e-09 2.408834257351563e-09 5.692567179411437e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.183893 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.797298741412877e-18 } }