{ "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" [ [ 0.665348 0.165348 0.5 ] [ 0.165348 0.334652 0.5 ] [ 0.834652 0.665348 0.5 ] [ 0.334652 0.834652 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.367373 0.132627 0 ] [ 0.867373 0.367373 0 ] [ 0.632627 0.867373 0 ] [ 0.132627 0.632627 0 ] ] } "species" { "source-value" [ "Pu" "Pu" "Pu" "Pu" "In" "In" "Ni" "Ni" "Ni" "Ni" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.32458793 "source-unit" "angstrom" } "c" { "source-value" 3.48154464 "source-unit" "angstrom" } }