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Stefan Goedecker
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2020 – today
- 2024
- [j11]Marco Krummenacher, Moritz Gubler, Jonas A. Finkler, Hannes Huber, Martin Sommer-Jörgensen, Stefan Goedecker:
Performing highly efficient Minima Hopping structure predictions using the Atomic Simulation Environment (ASE). SoftwareX 25: 101632 (2024) - [j10]Marco Krummenacher, Moritz Gubler, Jonas A. Finkler, Hannes Huber, Martin Sommer-Jörgensen, Stefan Goedecker:
Corrigendum to performing highly efficient minima hopping structure predictions using the Atomic Simulation Environment (ASE) [SoftwareX 25 (2024) 101632]. SoftwareX 26: 101645 (2024) - 2023
- [j9]Moritz Gubler
, Marco Krummenacher, Hannes Huber
, Stefan Goedecker
:
Efficient variable cell shape geometry optimization. J. Comput. Phys. X 17: 100131 (2023) - 2021
- [j8]Ehsan Rahmatizad KhajePasha
, Stefan Goedecker, S. Alireza Ghasemi:
New strontium titanate polymorphs under high pressure. J. Comput. Chem. 42(10): 699-705 (2021) - [j7]Behnam Parsaeifard
, Deb Sankar De, Anders S. Christensen, Felix A. Faber
, Emir Kocer
, Sandip De
, Jörg Behler, O. Anatole von Lilienfeld, Stefan Goedecker:
An assessment of the structural resolution of various fingerprints commonly used in machine learning. Mach. Learn. Sci. Technol. 2(1): 15018 (2021)
2010 – 2019
- 2013
- [j6]Nazim Dugan
, Luigi Genovese
, Stefan Goedecker:
A customized 3D GPU Poisson solver for free boundary conditions. Comput. Phys. Commun. 184(8): 1815-1820 (2013) - 2012
- [c3]Sadaf R. Alam, Gilles Fourestey, Brice Videau, Luigi Genovese
, Stefan Goedecker, Nazim Dugan
:
Overlapping Computations with Communications and I/O Explicitly Using OpenMP Based Heterogeneous Threading Models. IWOMP 2012: 267-270
2000 – 2009
- 2009
- [j5]Xavier Gonze, Bernard Amadon, Pierre-Matthieu Anglade, Jean-Michel Beuken, François Bottin, Paul Boulanger
, Fabien Bruneval
, Damien Caliste
, Razvan Caracas
, Michel Côté
, Thierry Deutsch
, Luigi Genovese
, Philippe Ghosez
, Matteo Giantomassi, Stefan Goedecker, Don R. Hamann, Patrick Hermet, François Jollet, Gerald Jomard, Stéphane Le Roux, Marco Mancini, Stephane Mazevet, Micael J. T. Oliveira
, Giovanni Onida
, Yann Pouillon
, Tonatiuh Rangel
, Gian-Marco Rignanese
, Davide Sangalli
, Riad Shaltaf
, Marc Torrent
, Matthieu J. Verstraete
, Gilles Zérah, Joe W. Zwanziger
:
ABINIT: First-principles approach to material and nanosystem properties. Comput. Phys. Commun. 180(12): 2582-2615 (2009) - 2006
- [j4]Alexey I. Neelov, Stefan Goedecker:
An efficient numerical quadrature for the calculation of the potential energy of wavefunctions expressed in the Daubechies wavelet basis. J. Comput. Phys. 217(2): 312-339 (2006) - 2003
- [j3]Stefan Goedecker, Gustavo E. Scuseria:
Linear scaling electronic structure methods in chemistry and physics. Comput. Sci. Eng. 5(4): 14-21 (2003)
1990 – 1999
- 1997
- [j2]Stefan Goedecker:
Fast Radix 2, 3, 4, and 5 Kernels for Fast Fourier Transformations on Computers with Overlapping Multiply-Add Instructions. SIAM J. Sci. Comput. 18(6): 1605-1611 (1997) - 1996
- [c2]Adolfy Hoisie, Stefan Goedecker, J. Hutter:
Electronic Structure of Materials using Self-Interaction Corrected Density Functional Theory. SC 1996: 49 - 1994
- [j1]Stefan Goedecker:
Remark on Algorithms to Find Roots of Polynomials. SIAM J. Sci. Comput. 15(5): 1059-1063 (1994) - [c1]Stefan Goedecker, Luciano Colombo:
Tight binding molecular dynamics. SC 1994: 670-672
Coauthor Index
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