{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7841196 0.2980683 -2.8906672 ] [ 0.7038318 2.0723128 -0.3706639 ] [ 0.8847129 -0.2650661 0.6647835 ] [ 0.758443 0.1740303 0.5571964 ] [ 0.7155076 -0.7133888 2.2079074 ] [ 0.0424557 -1.7157685 -1.1437891 ] [ -2.6059237 0.4517022 -0.0741521 ] [ -1.2831469 -0.3018902 1.049385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.256298101381426e-09 4.775580655961021e-10 -4.631359444510205e-09 ] [ 1.127662864226161e-09 3.320211146499115e-09 -5.938690396473124e-10 ] [ 1.417466336178378e-09 -4.246827118855074e-10 1.065100590368739e-09 ] [ 1.215159652820862e-09 2.788272802680101e-10 8.927270526289176e-10 ] [ 1.146369558169418e-09 -1.142974866317299e-09 3.537457646315691e-09 ] [ 6.802153052011379e-11 -2.748964200053229e-09 -1.832552170243889e-09 ] [ -4.175150062126825e-09 7.237067103663947e-10 -1.188047619820314e-10 ] [ -2.055827981169534e-09 -4.836814244735868e-10 1.68130012707009e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.959958 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.761420446722137e-18 } }