PAOFLOW: A utility to construct and operate on ab initio Hamiltonians from the projections of electronic wavefunctions on atomic orbital bases, including characterization of topological materials
Titel:
PAOFLOW: A utility to construct and operate on ab initio Hamiltonians from the projections of electronic wavefunctions on atomic orbital bases, including characterization of topological materials
Auteur:
Buongiorno Nardelli, Marco Cerasoli, Frank T. Costa, Marcio Curtarolo, Stefano De Gennaro, Riccardo Fornari, Marco Liyanage, Laalitha Supka, Andrew R. Wang, Haihang