{ "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" [ [ 0.0288618 -0.1474677 1.7525063 ] [ -0.5321724 0.8979392 -0.8653109 ] [ 0.1292428 -0.087614 -1.5454633 ] [ 1.1479938 1.0023057 0.5784999 ] [ -1.4775261 -2.6542874 -0.9686676 ] [ -0.1857323 1.0710149 1.3395572 ] [ -0.0358673 -1.2032787 -0.5888426 ] [ 0.9251996 1.1213881 0.2977211 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.62417015751812e-11 -2.362693032097218e-10 2.807824644797794e-09 ] [ -8.526341845397015e-10 1.438657204992653e-09 -1.38638090512551e-09 ] [ 2.070697942727352e-10 -1.40373103611276e-10 -2.476105187964532e-09 ] [ 1.839288842336869e-09 1.605870772665013e-09 9.268590225513364e-10 ] [ -2.367257793545147e-09 -4.252637252200611e-09 -1.551976594832858e-09 ] [ -2.975759512390781e-10 1.715955047445846e-09 2.146207245746465e-09 ] [ -5.746574998466819e-11 -1.927865017329896e-09 -9.434298548238082e-10 ] [ 1.482333180906146e-09 1.796661811465655e-09 4.770017898687773e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.381948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.829030698500303e-18 } }