{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4895199 -2.2360879 -2.4097108 ] [ 2.2923695 2.269401 1.090488 ] [ -0.3871724 0.1762839 -0.4697486 ] [ 0.4221783 0.1909929 1.3494343 ] [ 0.1395109 -0.7773343 -1.1661183 ] [ 0.1080335 0.1910659 0.2042652 ] [ -0.909073 -0.0034057 0.2693932 ] [ -0.176327 0.1890842 1.1319971 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.386473959996354e-09 -3.582607755433768e-09 -3.860782306649265e-09 ] [ 3.672780819134986e-09 3.635981225420141e-09 1.74715437886295e-09 ] [ -6.20318567499026e-10 2.824379432034451e-10 -7.526202245735309e-10 ] [ 6.764042020690888e-10 3.060043591187924e-10 2.162032086765613e-09 ] [ 2.235211023267667e-10 -1.245426842005934e-09 -1.868327477347041e-09 ] [ 1.730887479631968e-10 3.061213180121108e-10 3.272689278830362e-10 ] [ -1.456495507200518e-09 -5.45653291745856e-12 4.316154868424985e-10 ] [ -2.825069970158016e-10 3.029462846026714e-10 1.8136592884334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.44563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.640321942032711e-18 } }