{ "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" [ [ -0.2207828 -0.5779843 2.1249745 ] [ -0.3964057 1.7462788 -0.9696514 ] [ 0.0666389 -0.5521735 -2.0717634 ] [ 1.3685389 1.6435953 1.1908506 ] [ -2.1594289 -3.7170776 -1.4847334 ] [ -0.0169639 1.6562121 1.6843256 ] [ -0.0307185 -1.9171498 -0.74111 ] [ 1.3891222 1.718299 0.2671075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.537330404347623e-10 -9.260329326494535e-10 3.40458446369617e-09 ] [ -6.351119448918585e-10 2.797847066758679e-09 -1.553552803405989e-09 ] [ 1.067672876158291e-10 -8.846794723253088e-10 -3.319330883309119e-09 ] [ 2.192641030235349e-09 2.633329963716762e-09 1.907952990185653e-09 ] [ -3.459786497859861e-09 -5.955414828419375e-09 -2.378805141600895e-09 ] [ -2.717916397758912e-11 2.653544305706072e-09 2.698587098134932e-09 ] [ -4.92164625260448e-11 -3.071612588131396e-09 -1.187389115441088e-09 ] [ 2.225619112274262e-09 2.75301848534402e-09 4.27953391740336e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -33.74775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.406985605460321e-18 } }