{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.0182526 2.2024009 -0.7699562 ] [ -0.4510089 0.570738 -0.5696146 ] [ 1.4611177 2.60667 -1.0766928 ] [ -4.1077413 2.6201745 -4.0367959 ] [ -2.5716848 0.3263875 3.1678666 ] [ -2.2596035 -1.6344674 -0.7536647 ] [ 3.0122538 -3.2708066 2.18272 ] [ 0.8984145 -3.4210968 1.8561377 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.437950425229748e-09 3.528635260680571e-09 -1.233605832843431e-09 ] [ -7.225959213060426e-10 9.144230877358919e-10 -9.126232025052563e-10 ] [ 2.340968638463821e-09 4.176345766548779e-09 -1.725052046156035e-09 ] [ -6.581327129376784e-09 4.197982360902632e-09 -6.467660067207001e-09 ] [ -4.120293296572962e-09 5.22930426129675e-10 5.075481846149024e-09 ] [ -3.620283929804618e-09 -2.618705477314731e-09 -1.20750397221062e-09 ] [ 4.826162654037709e-09 -5.240409908852983e-09 3.49710298256448e-09 ] [ 1.439418719546793e-09 -5.481201355612171e-09 2.973860452426501e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -330.01969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.287498360779235e-17 } }