{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2mm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.002516 0 ] [ 0.5 0.502516 0 ] [ 0 0.613838 0.5 ] [ 0.5 0.113838 0.5 ] [ 0.152586 0.302323 0.5 ] [ 0.847414 0.302323 0.5 ] [ 0.652586 0.802323 0.5 ] [ 0.347414 0.802323 0.5 ] ] } "species" { "source-value" [ "Er" "Er" "Ni" "Ni" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.50634588244 "source-unit" "angstrom" } "b" { "source-value" 5.97836202714 "source-unit" "angstrom" } "c" { "source-value" 3.53707352 "source-unit" "angstrom" } }