Georg Kresse
The Litlas record for Georg Kresse includes 102 papers and 414,009 citations.
- 102
- Papers
- 414,009
- Citations
- 92
- h-index
- 99
- i10-index
Citations
Citation sources
Countries
Institutions
Fields
- Materials Science40.6%
- Engineering19.9%
- Energy12%
- Physics and Astronomy10.4%
- Chemical Engineering4.2%
- Chemistry3.8%
- Other9.1%
Topics
- Machine Learning in Materials Science4.2%
- Graphene research and applications3.7%
- 2D Materials and Applications3.7%
- Electrocatalysts for Energy Conversion3.4%
- Advanced Photocatalysis Techniques3.3%
- Advancements in Battery Materials2.7%
- Other79%
Coauthors
- J. Häfner15
- Martijn Marsman15
- Joachim A. Paier11
- Judith Harl9
- Jürgen Furthmüller9
- Ferenc Karsai8
- Ryosuke Jinnouchi8
- Andreas Grüneis7
- Jürgen Hafner7
- Kerstin Hummer6
- Laurids Schimka5
- Maxim Shishkin5
- Alessandro Stroppa4
- Cesare Franchini4
- Chris G. Van de Walle4
- Merzuk Kaltak4
- Michael J. Gillan4
- Michael Schmid4
- Ryoji Asahi4
- Yoon-Suk Kim4
- Alexander Rohrbach3
- Anderson Janotti3
- Carla Verdi3
- Dario Alfè3
Selected research
All papers
- Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
Authors: Georg Kresse, Jürgen Furthmüller - Physical review. B, Condensed matter 1996 cited by 123,939
- Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
Authors: Georg Kresse, Jürgen Furthmüller - Computational Materials Science 1996 cited by 76,620
- From ultrasoft pseudopotentials to the projector augmented-wave method
Authors: Georg Kresse, Daniel P. Joubert - Physical review. B, Condensed matter 1999 cited by 85,965
- Ab initio molecular dynamics for liquid metals
Authors: Georg Kresse, J. Häfner - Physical review. B, Condensed matter 1993 cited by 45,996
- Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
Authors: Georg Kresse, J. Häfner - Physical review. B, Condensed matter 1994 cited by 23,146
- On-the-fly machine learning force field generation: Application to melting points
Authors: Ryosuke Jinnouchi, Ferenc Karsai, Georg Kresse - Physical review. B./Physical review. B 2019 cited by 696
- Phase Transitions of Hybrid Perovskites Simulated by Machine-Learning Force Fields Trained on the Fly with Bayesian Inference
Authors: Ryosuke Jinnouchi, Jonathan Lahnsteiner, Ferenc Karsai, Georg Kresse, Menno Bokdam - Physical Review Letters 2019 cited by 650
- On-the-Fly Active Learning of Interatomic Potentials for Large-Scale Atomistic Simulations
Authors: Ryosuke Jinnouchi, Kazutoshi Miwa, Ferenc Karsai, Georg Kresse, Ryoji Asahi - The Journal of Physical Chemistry Letters 2020 cited by 210
- Ab initio molecular dynamics for open-shell transition metals
Authors: Georg Kresse, J. Häfner - Physical review. B, Condensed matter 1993 cited by 8,404
- Reproducibility in density functional theory calculations of solids
Authors: Kurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman, Peter Blaha, Stefan Blügel, Volker Blüm, Damien Caliste, Ivano E. Castelli, Stewart J. Clark, Andrea Dal Corso, Stefano de Gironcoli, Thierry Deutsch, J. K. Dewhurst, Igor Di Marco, Claudia Draxl, Marcin Dułak, Olle Eriksson, José A. Flores‐Livas, Kevin F. Garrity, Luigi Genovese, Paolo Giannozzi, Matteo Giantomassi, Stefan Goedecker, Xavier Gonze, Oscar Grånäs, Eberhard K. U. Gross, Andris Guļāns, François Gygi, Donald R. Hamann, Philip J. Hasnip, Natalie A. W. Holzwarth, Diana Iuşan, Dominik B. Jochym, Francois Jollet, Daniel Jones, Georg Kresse, Klaus Koepernik, Emine Küçükbenli, Y. O. Kvashnin, Inka L. M. Locht, S. Lübeck, Martijn Marsman, Nicola Marzari, Ulrike Nitzsche, Lars Nordström, Taisuke Ozaki, Lorenzo Paulatto, Chris J. Pickard, Ward Poelmans, Matt I. J. Probert, Keith Refson, Manuel Richter, Gian‐Marco Rignanese, Santanu Saha, Matthias Scheffler, Martin Schlipf, Karlheinz Schwarz, S. Sharma, Francesca Tavazza, Patrik Thunström, Alexandre Tkatchenko, Marc Torrent, David Vanderbilt, Michiel J. van Setten, Véronique Van Speybroeck, J. M. Wills, Jonathan R. Yates, Guoxu Zhang, Stefaan Cottenier - Science 2016 cited by 1,667
- First-principles calculations for point defects in solids
Authors: Christoph Freysoldt, Blazej Grabowski, Tilmann Hickel, Jörg Neugebauer, Georg Kresse, Anderson Janotti, Chris G. Van de Walle - Reviews of Modern Physics 2014 cited by 3,037
- Linear optical properties in the projector-augmented wave methodology
Authors: Marek Gajdoš, Kerstin Hummer, Georg Kresse, Jürgen Furthmüller, F. Bechstedt - Physical Review B 2006 cited by 3,537
- Ab initio molecular dynamics for liquid metals
Authors: Georg Kresse - Journal of Non-Crystalline Solids 1995 cited by 2,182
- Norm-conserving and ultrasoft pseudopotentials for first-row and transition elements
Authors: Georg Kresse, J. Häfner - Journal of Physics Condensed Matter 1994 cited by 3,970
- Descriptors representing two- and three-body atomic distributions and their effects on the accuracy of machine-learned inter-atomic potentials
Authors: Ryosuke Jinnouchi, Ferenc Karsai, Carla Verdi, Ryoji Asahi, Georg Kresse - The Journal of Chemical Physics 2020 cited by 264
- Comparing machine learning potentials for water: Kernel-based regression and Behler–Parrinello neural networks
Authors: Pablo Montero de Hijes, Christoph Dellago, Ryosuke Jinnouchi, Bernhard Schmiedmayer, Georg Kresse - The Journal of Chemical Physics 2024 cited by 49
- Accurate surface and adsorption energies from many-body perturbation theory
Authors: Laurids Schimka, Judith Harl, Alessandro Stroppa, Andreas Grüneis, Martijn Marsman, Florian Mittendorfer, Georg Kresse - Nature Materials 2010 cited by 625
- Towards an exact description of electronic wavefunctions in real solids
Authors: George H. Booth, Andreas Grüneis, Georg Kresse, Ali Alavi - Nature 2012 cited by 582
- Density-based long-range electrostatic descriptors for machine learning force fields
Authors: C. Faller, Merzuk Kaltak, Georg Kresse - The Journal of Chemical Physics 2024 cited by 19
- Screened hybrid density functionals applied to solids
Authors: Joachim A. Paier, Martijn Marsman, Kerstin Hummer, Georg Kresse, Iann C. Gerber, János G. Ángyán - The Journal of Chemical Physics 2006 cited by 2,464
- The Perdew–Burke–Ernzerhof exchange-correlation functional applied to the G2-1 test set using a plane-wave basis set
Authors: Joachim A. Paier, Robin Hirschl, Martijn Marsman, Georg Kresse - The Journal of Chemical Physics 2005 cited by 1,053
- Theory of the crystal structures of selenium and tellurium: The effect of generalized-gradient corrections to the local-density approximation
Authors: Georg Kresse, Jürgen Furthmüller, J. Häfner - Physical review. B, Condensed matter 1994 cited by 586
- Nonrad: Computing nonradiative capture coefficients from first principles
Authors: Mark E. Turiansky, Audrius Alkauskas, Manuel Engel, Georg Kresse, Darshana Wickramaratne, Jimmy-Xuan Shen, Cyrus E. Dreyer, Chris G. Van de Walle - Computer Physics Communications, Comput. Phys. Commun. 2021 cited by 140
- Machine learning-aided first-principles calculations of redox potentials
Authors: Ryosuke Jinnouchi, Ferenc Karsai, Georg Kresse - npj Computational Materials 2024 cited by 35
