{ "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" [ [ 6.6571982 1.3089511 -0.5650162 ] [ -0.8640407 1.3888707 -4.1218698 ] [ 2.2632585 3.7929336 -1.4833877 ] [ -15.108106 13.1217923 -14.8538903 ] [ -3.0173705 1.5550243 8.0066482 ] [ -4.5099714 -0.0341009 -0.5245838 ] [ 13.3948532 -13.289215 13.3119775 ] [ 1.1841787 -7.844256 0.2301221 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.066600731607184e-08 2.097170850190443e-09 -9.052557460132569e-10 ] [ -1.384345808959667e-09 2.22521616485413e-09 -6.603963427541571e-09 ] [ 3.626139855526877e-09 6.076949538166779e-09 -2.376649092522284e-09 ] [ -2.420585421776821e-08 2.102342884605346e-08 -2.37985557665879e-08 ] [ -4.834360471391607e-09 2.491423578235885e-09 1.28280645570104e-08 ] [ -7.225770737556646e-09 -5.463566472823873e-11 -8.404759000104231e-10 ] [ 2.146092063608806e-08 -2.129166958178467e-08 2.132813912711563e-08 ] [ 1.897263427989337e-09 -1.256788357077012e-08 3.686962485493997e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -32.15554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.151885441719924e-18 } }