Relation between chemical bonding and exchange coupling approaches to the description of ordering in itinerant magnets. - German D. Samolyuk; Gordon J. Miller (J. Comput. Chem., 2008)

Magnetic ordering and metal-atom site preference in tetragonal CrMnAs: Electronic correlation effects. - Laura Lutz-Kappelman; Yuemei Zhang; Gordon J. Miller (J. Comput. Chem., 2018)