{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.938317 0.25 ] [ 0 0.061683 0.75 ] [ 0.5 0.438317 0.25 ] [ 0.5 0.561683 0.75 ] [ 0.5 0.844213 0.945782 ] [ 0.5 0.155787 0.054218 ] [ 0.5 0.155787 0.445782 ] [ 0.5 0.844213 0.554218 ] [ 0 0.344213 0.945782 ] [ 0 0.655787 0.054218 ] [ 0 0.655787 0.445782 ] [ 0 0.344213 0.554218 ] [ 0 0.215809 0.25 ] [ 0 0.784191 0.75 ] [ 0.5 0.715809 0.25 ] [ 0.5 0.284191 0.75 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Al" "Ni" "Ni" "Ni" "Ni" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.05004599 "source-unit" "angstrom" } "b" { "source-value" 10.14063496 "source-unit" "angstrom" } "c" { "source-value" 6.86845424 "source-unit" "angstrom" } }