{ "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" [ [ -0.2404084 -0.9473851 2.4665771 ] [ -0.9524454 2.1561473 -1.2200335 ] [ -0.2560754 -1.1064989 -2.9916704 ] [ 2.4055742 2.4053007 0.9081882 ] [ -2.8859311 -5.5446866 -2.1596479 ] [ 0.482084 3.3716089 3.4346877 ] [ -0.5523978 -2.8251663 -1.2811418 ] [ 1.9995999 2.4906799 0.8430406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.851767210973256e-10 -1.517878270619753e-09 3.951892195579481e-09 ] [ -1.525985765040784e-09 3.454528823522188e-09 -1.954709166397239e-09 ] [ -4.102780224222036e-10 -1.772806683126702e-09 -4.793184411509433e-09 ] [ 3.854154774593243e-09 3.853716579283844e-09 1.455077913314519e-09 ] [ -4.623771375753916e-09 -8.883567313372905e-09 -3.460137403047168e-09 ] [ 7.72383720425256e-10 5.401912998566442e-09 5.502976378027201e-09 ] [ -8.850388478330052e-10 -4.526415433024233e-09 -2.052615456800701e-09 ] [ 3.203712237128736e-09 3.990509138553456e-09 1.35069995083334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.84488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.742982918453392e-18 } }