Principle Collaborator:Natarajan Sukumar(University of California, Davis)Over the past few decades, the planewave (PW) pseudopotential method has established itself as the dominant method for large, accurate, density-functional calculations in condensed matter. However, due to its global Fourier basis, the PW method suffers from substantial inef...
Creator:
Pask, John E. (Lawrence Livermore National Laboratory)
Created:
2008-10-03
Contributed By:
University of Minnesota, Institute for Mathematics and its Applications.