{ "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" [ [ 0.003926 0.084812 0.387705 ] [ 0.506236 0.426264 0.866714 ] [ 0.003217 0.562686 0.125475 ] [ 0.505655 0.906121 0.622709 ] [ 0.49454 0.915439 0.123454 ] [ 0.025366 0.098135 0.849681 ] [ 0.487985 0.425574 0.394762 ] [ 0.006635 0.584773 0.627553 ] [ 0.611798 0.075184 0.888433 ] [ 0.606729 0.074653 0.354823 ] [ 0.120202 0.425576 0.869381 ] [ 0.104396 0.41668 0.387724 ] [ 0.637192 0.585147 0.626086 ] [ 0.610656 0.603666 0.124789 ] [ 0.121373 0.89856 0.623822 ] [ 0.127697 0.916728 0.126887 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Nb" "Fe" "Fe" "Fe" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.16308864 "source-unit" "angstrom" } "b" { "source-value" 5.75137913 "source-unit" "angstrom" } "c" { "source-value" 6.60304481 "source-unit" "angstrom" } "alpha" { "source-value" 89.22178883 "source-unit" "degree" } "beta" { "source-value" 89.80317648 "source-unit" "degree" } "gamma" { "source-value" 89.81295792 "source-unit" "degree" } }