Georg Kresse

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Jürgen FurthmüllerFriedrich-Schiller-Universität JenaVerifierad e-postadress på uni-jena.de
Martijn MarsmanUniversity Vienna, Faculty of Physics and Center for Computational Materials ScienceVerifierad e-postadress på univie.ac.at
Cesare FranchiniUniversity of Vienna & University of BolognaVerifierad e-postadress på univie.ac.at
Joachim PaierFriedrich-Alexander-Universität Erlangen-NürnbergVerifierad e-postadress på fau.de
Andreas GrüneisVienna University of TechnologyVerifierad e-postadress på tuwien.ac.at
Edvin LundgrenProfessor, Lund UniversityVerifierad e-postadress på sljus.lu.se
Chris G. Van de WalleProfessor of Materials, University of California, Santa BarbaraVerifierad e-postadress på mrl.ucsb.edu
Peitao LiuUniversity of ViennaVerifierad e-postadress på univie.ac.at
Friedhelm BechstedtProfessor für Festkörpertheorie, Friedrich Schiller Universität JenaVerifierad e-postadress på ifto.physik.uni-jena.de
Maxim ShishkinKyoto UniversityVerifierad e-postadress på kyoto-u.ac.jp
Anders mikkelsenProfessor, Department of Physics, Lund UniversityVerifierad e-postadress på sljus.lu.se
Anderson JanottiUniversity of DelawareVerifierad e-postadress på udel.edu
Ryosuke JinnouchiToyota Central R&D Labs., Inc.Verifierad e-postadress på mosk.tytlabs.co.jp
Pascal RaybaudIFP Energies nouvellesVerifierad e-postadress på ifpen.fr
Jiri KlimesResearcher (academic), Faculty of Mathematics and Physics, Charles University, PragueVerifierad e-postadress på karlov.mff.cuni.cz
János G. ÁngyánCRM2 CNRS & Université de LorraineVerifierad e-postadress på univ-lorraine.fr
Menno BokdamUniversity of TwenteVerifierad e-postadress på utwente.nl
Carla VerdiUniversity of QueenslandVerifierad e-postadress på uq.edu.au
Ulrike DieboldTU Wien / Vienna University of TechnologyVerifierad e-postadress på iap.tuwien.ac.at
Dipankar Das Sarma (D D Sarma)Indian Institute of ScienceVerifierad e-postadress på iisc.ac.in

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Georg Kresse

University of Vienna, Faculty of Physics, Professor for Computational Quantum Mechanics

Verifierad e-postadress på univie.ac.at - Startsida

density functional theory first principles calculations many body theory condensed matter physics materials science


Titel Sortera efter citat Sortera efter år Sortera efter titel	Citeras av Citeras av	År
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	115312	1996
From ultrasoft pseudopotentials to the projector augmented-wave method G Kresse, D Joubert Physical review b 59 (3), 1758, 1999	80709	1999
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	70998	1996
Ab initio molecular dynamics for liquid metals G Kresse, J Hafner Physical review B 47 (1), 558, 1993	46293	1993
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	22571	1994
Ab initio molecular dynamics for open-shell transition metals G Kresse, J Hafner Physical Review B 48 (17), 13115, 1993	8012	1993
Computational Mater G Kresse, J Furthmüller Sci 6 (1), 15, 1996	6212	1996
Norm-conserving and ultrasoft pseudopotentials for first-row and transition elements G Kresse, J Hafner Journal of Physics: Condensed Matter 6 (40), 8245, 1994	5538	1994
Linear optical properties in the projector-augmented wave methodology M Gajdoš, K Hummer, G Kresse, J Furthmüller, F Bechstedt Physical Review B—Condensed Matter and Materials Physics 73 (4), 045112, 2006	2950	2006
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), 253-305, 2014	2762	2014
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), 2006	2736	2006
Defect energetics in ZnO: A hybrid Hartree-Fock density functional study F Oba, A Togo, I Tanaka, J Paier, G Kresse Physical Review B—Condensed Matter and Materials Physics 77 (24), 245202, 2008	1467	2008
Software VASP, vienna (1999) G Kresse, J Furthmüller Phys. Rev. B 54 (11), 169, 1996	1462	1996
Reproducibility in density functional theory calculations of solids K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ... Science 351 (6280), aad3000, 2016	1411	2016
Self-consistent calculations for semiconductors and insulators M Shishkin, G Kresse Physical Review B—Condensed Matter and Materials Physics 75 (23), 235102, 2007	1115	2007
Ab initio molecular dynamics for liquid metals G Kresse Journal of Non-Crystalline Solids 192, 222-229, 1995	1060	1995
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 The Journal of chemical physics 122 (23), 2005	1057	2005
Implementation and performance of the frequency-dependent method within the PAW framework M Shishkin, G Kresse Physical Review B—Condensed Matter and Materials Physics 74 (3), 035101, 2006	1050	2006
D. Joubert Phys. Rev. B G Kresse Condens. Matter Mater. Phys 59, 1758, 1999	1008	1999
Ab initio force constant approach to phonon dispersion relations of diamond and graphite G Kresse, J Furthmüller, J Hafner Europhysics Letters 32 (9), 729, 1995	955	1995

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