{ "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" [ [ 0.41735 0.493254 0.140954 ] [ 0.614899 0.789541 0.660606 ] [ 0.178344 0.23152 0.204887 ] [ 0.675321 0.993388 0.509791 ] [ 0.011906 0.67188 0.21451 ] [ 0.426988 0.45787 0.899783 ] [ 0.163135 0.847312 0.814779 ] [ 0.530908 0.523986 0.536756 ] ] } "species" { "source-value" [ "Fe" "Fe" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.75502169 "source-unit" "angstrom" } "b" { "source-value" 7.59163804 "source-unit" "angstrom" } "c" { "source-value" 8.87734095 "source-unit" "angstrom" } "alpha" { "source-value" 95.03394074 "source-unit" "degree" } "beta" { "source-value" 94.08800237 "source-unit" "degree" } "gamma" { "source-value" 102.73573 "source-unit" "degree" } }