{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6985758 1.7110271 -3.8789064 ] [ -2.5031852 -2.3607244 1.0012005 ] [ 0.2850239 0.2245299 0.7045442 ] [ 0.0506159 0.898714 0.8509315 ] [ 0.0887361 -0.694527 1.5869751 ] [ -0.1057718 -0.6695633 2.2700728 ] [ 1.2139259 1.1902071 -4.015651 ] [ -0.7279207 -0.2996634 1.4808334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.721418457837857e-09 2.741367639760781e-09 -6.214693199553056e-09 ] [ -4.010544838014616e-09 -3.78229747299367e-09 1.604100047049117e-09 ] [ 4.566586327115525e-10 3.597365594143566e-10 1.128804254860223e-09 ] [ 8.109561228888059e-11 1.439898571448676e-09 1.363342566434571e-09 ] [ 1.421709060122874e-10 -1.112754931082118e-09 2.542614423959813e-09 ] [ -1.694651064961212e-10 -1.072758674243932e-09 3.637057597638955e-09 ] [ 1.94492371238742e-09 1.906922005240901e-09 -6.433782202498734e-09 ] [ -1.166257536944924e-09 -4.801136975449955e-10 2.372556672326775e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.73207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.724908763845238e-18 } }