{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0.824673 0.675327 0.5 ] [ 0.324673 0.824673 0.5 ] [ 0.175327 0.324673 0.5 ] [ 0.675327 0.175327 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0 ] [ 0.126148 0.626148 0 ] [ 0.626148 0.873852 0 ] [ 0.373852 0.126148 0 ] [ 0.873852 0.373852 0 ] ] } "species" { "source-value" [ "Ta" "Ta" "Ta" "Ta" "Ta" "Ta" "Ga" "Ga" "Ga" "Ga" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.90953668 "source-unit" "angstrom" } "c" { "source-value" 3.51744505 "source-unit" "angstrom" } }