{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.88419 0.38419 0 ] [ 0.38419 0.11581 0 ] [ 0.11581 0.61581 0 ] [ 0.61581 0.88419 0 ] [ 0.17791 0.32209 0.5 ] [ 0.67791 0.17791 0.5 ] [ 0.32209 0.82209 0.5 ] [ 0.82209 0.67791 0.5 ] ] } "species" { "source-value" [ "Fe" "Fe" "B" "B" "B" "B" "W" "W" "W" "W" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.69061688 "source-unit" "angstrom" } "c" { "source-value" 3.23393637 "source-unit" "angstrom" } }