{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4/mcm" } "basis-atom-coordinates" { "source-value" [ [ 0.661072 0.838928 0.873262 ] [ 0.838928 0.338928 0.126738 ] [ 0.161072 0.661072 0.126738 ] [ 0.161072 0.661072 0.873262 ] [ 0 0 0 ] [ 0.338928 0.161072 0.873262 ] [ 0.338928 0.161072 0.126738 ] [ 0.838928 0.338928 0.873262 ] [ 0.661072 0.838928 0.126738 ] [ 0.5 0.5 0 ] [ 0.161072 0.338928 0.373262 ] [ 0.338928 0.838928 0.626738 ] [ 0.661072 0.161072 0.626738 ] [ 0.661072 0.161072 0.373262 ] [ 0.5 0.5 0.5 ] [ 0.838928 0.661072 0.373262 ] [ 0.838928 0.661072 0.626738 ] [ 0.338928 0.838928 0.373262 ] [ 0.161072 0.338928 0.626738 ] [ 0 0 0.5 ] [ 0.633806 0.133806 0 ] [ 0.366194 0.866194 0 ] [ 0.866194 0.633806 0 ] [ 0.133806 0.366194 0 ] [ 0.133806 0.633806 0.5 ] [ 0.866194 0.366194 0.5 ] [ 0.366194 0.133806 0.5 ] [ 0.633806 0.866194 0.5 ] [ 0.5 0.5 0.75 ] [ 0 0 0.75 ] [ 0 0 0.25 ] [ 0.5 0.5 0.25 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Ho" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Bi" "Bi" "Bi" "Bi" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.51371234229 "source-unit" "angstrom" } "c" { "source-value" 14.1868121007 "source-unit" "angstrom" } }