FEASIBILITY OF A NOVEL DENSITY FUNCTIONAL METHOD OUTSIDE THE KOHN-SHAM FRAMEWORK FOR MODELING GLOBAL POTENTIAL ENERGY SURFACES OF MOLECULAR CHEMICAL REACTIONS

$11,926FY2020Department of EnergyDOE

The Pennsylvania State University

Investigators

FEASIBILITY OF A NOVEL DENSITY FUNCTIONAL METHOD OUTSIDE THE KOHN-SHAM FRAMEWORK FOR MODELING GLOBAL POTENTIAL ENERGY SURFACES OF MOLECULAR CHEMICAL REACTIONS · GrantIndex