asked by Philipp Hansmann (2017/12/15 15:39)
Dear Developers, Is there a documentation for the function “PotentialExpandedOnClm” where the parametrization of the implemented point groups is defined. E.g. how can I know that in the cubic case “PotentialExpandedOnClm(“Oh”, 2, {0.6,-0.4})” the first argument in the curly brackets is the eg energy and the second one the t2g instead of the other way around? What is the order for D4h etc… Thanks! Philipp