Georg Kresse
Georg Kresse
University of Vienna, Faculty of Physics, Professor for Computational Quantum Mechanics
Verified email at univie.ac.at - Homepage
Title
Cited by
Cited by
Year
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
G Kresse, J Furthmüller
Physical review B 54 (16), 11169, 1996
716891996
From ultrasoft pseudopotentials to the projector augmented-wave method
G Kresse, D Joubert
Physical review b 59 (3), 1758, 1999
517031999
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
G Kresse, J Furthmüller
Computational materials science 6 (1), 15-50, 1996
440061996
Ab initio molecular dynamics for liquid metals
G Kresse, J Hafner
Physical review B 47 (1), 558, 1993
322661993
Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
G Kresse, J Hafner
Physical Review B 49 (20), 14251, 1994
161311994
Ab initio molecular dynamics for open-shell transition metals
G Kresse, J Hafner
Physical Review B 48 (17), 13115, 1993
58311993
Norm-conserving and ultrasoft pseudopotentials for first-row and transition elements
G Kresse, J Hafner
Journal of Physics: Condensed Matter 6 (40), 8245, 1994
40431994
Linear optical properties in the projector-augmented wave methodology
M Gajdoš, K Hummer, G Kresse, J Furthmüller, F Bechstedt
Physical Review B 73 (4), 045112, 2006
20132006
Screened hybrid density functionals applied to solids
J Paier, M Marsman, K Hummer, G Kresse, IC Gerber, JG Ángyán
The Journal of chemical physics 124 (15), 154709, 2006
20002006
Screened hybrid density functionals applied to solids
J Paier, M Marsman, K Hummer, G Kresse, IC Gerber, JG Ángyán
The Journal of chemical physics 124 (15), 154709, 2006
20002006
14251; G. Kresse, J. Furthmüller
G Kresse, J Hafner
Phys. Rev. B 54, 11169, 1996
15161996
First-principles calculations for point defects in solids
C Freysoldt, B Grabowski, T Hickel, J Neugebauer, G Kresse, A Janotti, ...
Reviews of modern physics 86 (1), 253, 2014
14502014
Defect energetics in ZnO: A hybrid Hartree-Fock density functional study
F Oba, A Togo, I Tanaka, J Paier, G Kresse
Physical Review B 77 (24), 245202, 2008
13452008
Software VASP, vienna (1999)
G Kresse, J Furthmüller
Phys. Rev. B 54 (11), 169, 1996
13141996
Self-consistent calculations for semiconductors and insulators
M Shishkin, G Kresse
Physical Review B 75 (23), 235102, 2007
8552007
Implementation and performance of the frequency-dependent method within the PAW framework
M Shishkin, G Kresse
Physical Review B 74 (3), 035101, 2006
8202006
Reproducibility in density functional theory calculations of solids
K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ...
Science 351 (6280), 2016
799*2016
G. kresse and d. joubert, phys. rev. b 59, 1758 (1999)
G Kresse
Phys. Rev. B 59, 1758, 1999
7641999
Ab initio force constant approach to phonon dispersion relations of diamond and graphite
G Kresse, J Furthmüller, J Hafner
EPL (Europhysics Letters) 32 (9), 729, 1995
7151995
Fully unconstrained noncollinear magnetism within the projector augmented-wave method
D Hobbs, G Kresse, J Hafner
Physical Review B 62 (17), 11556, 2000
7112000
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Articles 1–20