The Projector Augmented-wave Method

Projector augmented-wave method

P. E. Blöchl · 1994

Earlier work this paper cites.

Exact kohn-sham scheme based on perturbation theory

A. Görling and M. Levy · 1994

Earlier work this paper cites.

Electron-energy-loss spectra and the structural stability of nickel oxide: An lsda+u study

S. L. Dudarev, G. A. Botton, S. Y. Savrasov, C. J. Humphreys, and A. P. Sutton · 1998

Earlier work this paper cites.

From ultrasoft pseudopotentials to the projector augmented-wave method

G. Kresse and D. Joubert · 1999

Earlier work this paper cites.

Projector augmented wave method: ab-initio molecular dynamics with full wave functions

P. E. Blöchl, C. J. Först, and J. Schimpl · 2003

Earlier work this paper cites.

A Primer in Density Functional Theory

C. Fiolhais, F. Nogueira, and M. Margues, editors · 2003

Cited alongside, same era.

Simple iterative construction of the optimized effective potential for orbital functionals, including exact exchange

S. Kümmel and J. P. Perdew · 2003

Cited alongside, same era.

Molecular adsorption on the surface of strongly correlated transition-metal oxides: A case study for co/nio(100)

A. Rohrbach, J. Hafner, and G. Kresse · 2004

Cited alongside, same era.

Partly occupied wannier functions: Construction and applications

K. S. Thygesen, L. B. Hansen, and K. W. Jacobsen · 2005

Cited alongside, same era.

The perdew–burke–ernzerhof exchange-correlation functional applied to the g2-1 test set using a plane-wave basis set

Joachim Paier, Robin Hirschl, Martijn Marsman, and Georg Kresse · 2005

Cited alongside, same era.

The open-source project gpaw. freely available at https://wiki.fysik.dtu.dk/gpaw

Cited in the paper.

Maximally localized wannier functions constructed from projector-augmented waves or ultrasoft pseudopotentials

A Ferretti, A Calzolari, B Bonferroni, and R Di Felice · 2007

Later among the works it cites.

Time-dependent density-functional theory in the projector augmented-wave method

Michael Walter, Hannu Häkkinen, Lauri Lehtovaara, Martti Puska, Jussi Enkovaara, Carsten Rostgaard, and Jens Jørgen Mortensen · 2008

Later among the works it cites.

Bright beaches of nanoscale potassium islands on graphite in stm imaging

F. Yin, J. Akola, P. Koskinen, M. Manninen, and R. E. Palmer · 2009

Closest in time.

A grid-based bader analysis algorithm without lattice bias

W Tang, E Sanville, and G Henkelman · 2009

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Assessment of the gw approximation for molecules. ii. ionization potentials from first principles and comparison to hybrid density functional theory

Carsten Rostgaard, Karsten W. Jacobsen, and Kristian S. Thygesen · 2009

Closest in time.