{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0 ] [ 0 0 0 ] [ 0.844051 0.5 0.74962 ] [ 0.155949 0.5 0.25038 ] [ 0.322715 0 0.74056 ] [ 0.677285 0 0.25944 ] ] } "species" { "source-value" [ "Zr" "Ti" "Te" "Te" "Te" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.70266789 "source-unit" "angstrom" } "b" { "source-value" 3.88223158 "source-unit" "angstrom" } "c" { "source-value" 6.9428473 "source-unit" "angstrom" } "beta" { "source-value" 90.12728196 "source-unit" "degree" } }