{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.098119 0.583419 0.242902 ] [ 0.002808 0.717492 0.451345 ] [ 0.228544 0.710123 0.044545 ] [ 0.997203 0.414836 0.751343 ] [ 0.991568 0.282637 0.547453 ] [ 0.776857 0.292273 0.9561 ] [ 0.119341 0.971192 0.849341 ] [ 0.342388 0.978056 0.653192 ] [ 0.652991 0.034543 0.346148 ] [ 0.869008 0.015051 0.151117 ] [ 0.890112 0.755315 0.749172 ] [ 0.24098 0.801283 0.353676 ] [ 0.614317 0.841525 0.050062 ] [ 0.016562 0.328325 0.075688 ] [ 0.336732 0.224444 0.749492 ] [ 0.80847 0.329096 0.43443 ] [ 0.628907 0.247136 0.249762 ] [ 0.922775 0.189831 0.85858 ] [ 0.250081 0.153098 0.557834 ] [ 0.743528 0.844591 0.43675 ] [ 0.080353 0.80886 0.143255 ] [ 0.35577 0.769293 0.75561 ] [ 0.608655 0.773124 0.240739 ] [ 0.999781 0.67235 0.931623 ] [ 0.195723 0.675893 0.569454 ] [ 0.759746 0.197378 0.647629 ] [ 0.392833 0.169904 0.943515 ] [ 0.07597 0.219131 0.259242 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Mn" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.48373626 "source-unit" "angstrom" } "b" { "source-value" 5.65954801 "source-unit" "angstrom" } "c" { "source-value" 14.15021344 "source-unit" "angstrom" } "alpha" { "source-value" 89.15546064 "source-unit" "degree" } "beta" { "source-value" 93.87639745 "source-unit" "degree" } "gamma" { "source-value" 118.61212896 "source-unit" "degree" } }