Concepedia

Matthias Krack

MK

Statistics

Publications

52

Citations

15.8K

H-Index

29

Active since

1992

Affiliations

Paul Scherrer Institute(Current)

ETH Zurich

University of Zurich

University of Cambridge

University of Milano-Bicocca

Matthias Krack is an author at Paul Scherrer Institute specializing in natural sciences, physics, and chemistry.

ORCID

Publications per year

1992–2023

52

Publications

52

Quickstep: Fast and accurate density functional calculations using a mixed Gaussian and plane waves approach

Joost VandeVondele, Matthias Krack, Fawzi Mohamed et al. · Computer Physics Communications · 2005 · 5.7K citations · Full text

, , +14

CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations

Thomas D. Kühne, Marcella Iannuzzi, Mauro Del Ben et al. · The Journal of Chemical Physics · 2020 · 4.1K citations · Full text

, , +17

Pseudopotentials for H to Kr optimized for gradient-corrected exchange-correlation functionals

Matthias Krack · Theoretical Chemistry Accounts · 2005 · 1.8K citations · Full text

, , +9

The influence of temperature and density functional models in <i>ab initio</i> molecular dynamics simulation of liquid water

Joost VandeVondele, Fawzi Mohamed, Matthias Krack et al. · The Journal of Chemical Physics · 2004 · 502 citations

, , +17

Efficient and Accurate Car-Parrinello-like Approach to Born-Oppenheimer Molecular Dynamics

Thomas D. Kühne, Matthias Krack, Fawzi Mohamed et al. · Physical Review Letters · 2007 · 456 citations · Full text

, , +17

1–5 of 52