{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/mmm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.176782 ] [ 0.5 0.5 0.823218 ] [ 0 0 0.676782 ] [ 0 0 0.323218 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0 0 0.128 ] [ 0 0 0.872 ] [ 0.5 0.5 0.628 ] [ 0.5 0.5 0.372 ] ] } "species" { "source-value" [ "Hf" "Hf" "Hf" "Hf" "V" "V" "V" "V" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.72571281467 "source-unit" "angstrom" } "c" { "source-value" 14.4303196854 "source-unit" "angstrom" } }