{ "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" [ [ 0.993043 0.008444 0.661428 ] [ 0.004354 0.992563 0.34403 ] [ 0.670141 0.66108 0.260554 ] [ 0.337732 0.329756 0.346174 ] [ 0.001295 0.000313 0.994416 ] [ 0.666274 0.670715 0.674128 ] [ 0.983759 0.681357 0.48613 ] [ 0.304264 0.682425 0.189425 ] [ 0.020877 0.298221 0.192798 ] [ 0.342576 0.973258 0.489178 ] [ 0.30649 0.732038 0.815411 ] [ 0.690726 0.00453 0.190748 ] [ 0.72253 0.966011 0.81838 ] [ 0.679969 0.332445 0.485655 ] [ 0.955554 0.323855 0.818463 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Fe" "Fe" "Fe" "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" 5.20457753 "source-unit" "angstrom" } "b" { "source-value" 5.21001033 "source-unit" "angstrom" } "c" { "source-value" 7.66011687 "source-unit" "angstrom" } "alpha" { "source-value" 89.86488992 "source-unit" "degree" } "beta" { "source-value" 89.88291662 "source-unit" "degree" } "gamma" { "source-value" 60.36033078 "source-unit" "degree" } }