{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/n" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.25 0.75 ] [ 0.75 0.75 0.25 ] [ 0.907912 0.028783 0.858354 ] [ 0.407912 0.528783 0.141646 ] [ 0.528783 0.092088 0.358354 ] [ 0.971217 0.407912 0.358354 ] [ 0.592088 0.471217 0.858354 ] [ 0.092088 0.971217 0.141646 ] [ 0.471217 0.907912 0.641646 ] [ 0.028783 0.592088 0.641646 ] [ 0.594337 0.360733 0.357532 ] [ 0.905663 0.139267 0.357532 ] [ 0.860733 0.405663 0.857532 ] [ 0.360733 0.905663 0.142468 ] [ 0.405663 0.639267 0.642468 ] [ 0.094337 0.860733 0.642468 ] [ 0.139267 0.594337 0.142468 ] [ 0.639267 0.094337 0.857532 ] ] } "species" { "source-value" [ "Eu" "Eu" "B" "B" "B" "B" "B" "B" "B" "B" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" "Ir" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.69960208 "source-unit" "angstrom" } "c" { "source-value" 3.98075117 "source-unit" "angstrom" } }