Articles on the PAW formalism

The original article introducing the PAW formalism:

P. E. Blöchl

Projector augmented-wave method

Physical Review B, Vol. 50, 17953, 1994

A different formulation of PAW by Kresse and Joubert designed to make the transition from USPP to PAW easy.

G. Kresse and D. Joubert

From ultrasoft pseudopotentials to the projector augmented-wave method

Physical Review B, Vol. 59, 1758, 1999

A second, more pedagogical, article on PAW by Blöchl and co-workers.

P. E. Blöchl, C. J. Först, and J. Schimpl

Projector Augmented Wave Method: ab-initio molecular dynamics with full wave functions

Bulletin of Materials Science, Vol. 26, 33, 2003