{ "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" [ [ 4.1930796 0.6115437 -1.2418328 ] [ -0.5732603 0.4782002 -1.608977 ] [ 1.7069707 2.3296128 -0.9936756 ] [ -10.9359511 8.851511 -9.6927868 ] [ -1.8673726 1.3657704 4.4052353 ] [ -2.4233913 0.1527521 0.1751797 ] [ 9.42258 -8.7113816 8.3758459 ] [ 0.4773449 -5.0780085 0.5810112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.718054104273416e-09 9.798010187375289e-10 -1.989635479102602e-09 ] [ -9.184642502927942e-10 7.661611805018842e-10 -2.577865332804922e-09 ] [ 2.73486854793061e-09 3.732451163676426e-09 -1.592043814979412e-09 ] [ -1.752132517863205e-08 1.418168398295403e-08 -1.552955640135884e-08 ] [ -2.99186072204251e-09 2.188205404260664e-09 7.057965006782875e-09 ] [ -3.882700883910119e-09 2.447358433981037e-10 2.806688197787578e-10 ] [ 1.509663738361766e-08 -1.39571719343873e-08 1.341958448040353e-08 ] [ 7.64790838838114e-10 -8.135866498923677e-09 9.30882561062953e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.054017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.456054988172576e-18 } }