Accurate Quasiparticle Spectra from Self-Consistent GW Calculations with Vertex Corrections

M. Shishkin, M. Marsman, and G. Kresse

Phys. Rev. Lett. 99, 246403 (2007)

Screened hybrid density functionals applied to solids J. Paier, M. Marsman, K. Hummer, G. Kresse, I. C. Gerber, J. G. Ángyán

J. Chem. Phys. 124, 154709 (2006), and erratum: J. Chem. Phys. 125, 249901 (2006)

Linear optical properties in the projector-augmented wave methodology M. Gajdoš, K. Hummer, G. Kresse, J. Furthmüller, and F. Bechstedt

Phys. Rev. B 73, 045112 (2006)

The Perdew–Burke–Ernzerhof exchange-correlation functional applied to the G2-1 test set using a plane-wave basis set J. Paier, R. Hirschl, M. Marsman, G. Kresse

J. Chem. Phys. 122, 234102 (2005)

From ultrasoft pseudopotentials to the projector augmented-wave method G. Kresse, D. Joubert

Phys. Rev. B 59, 1758–1775 (1999)

Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. G. Kresse, J. Furthmüller

Phys. Rev. B 54, 11169–11186 (1996)

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. G. Kresse, J. Furthmüller

Computational Materials Science, Volume 6, Issue 1, July 1996, Pages 15-50

Projector augmented-wave method P. E. Blöchl

Phys. Rev. B 50, 17953–17979 (1994)