U

Researcher Profile

Ute Becker

🏛 Max-Planck-Institute for Kohlenforschung, Mülheim an der Ruhr 45470, Germany

3

Publications

7,564

Citations

8

Co-Authors

3

Active Years

Publications

Journal Article Journal of Chemical Theory and Computation Jul 18, 2021

Nudged Elastic Band Method for Molecular Reactions Using Energy-Weighted Springs Combined with Eigenvector Following

Vilhjálmur Ásgeirsson · Benedikt Orri Birgisson · Ragnar Bjornsson · Ute Becker +3 more

10.1021/acs.jctc.1c00462 391 citations

Open Access Journal Article The Journal of Chemical Physics Jun 12, 2020

The ORCA quantum chemistry program package

Frank Neese · Frank Wennmohs · Ute Becker · Christoph Riplinger

10.1063/5.0004608 4,419 citations

Journal Article Chemical Physics Feb 01, 2009

Efficient, approximate and parallel Hartree–Fock and hybrid DFT calculations. A ‘chain-of-spheres’ algorithm for the Hartree–Fock exchange

Frank Neese · Frank Wennmohs · Andreas Hansen · Ute Becker

10.1016/j.chemphys.2008.10.036 2,754 citations

Publication Timeline

2021

1

2020

1

2009

1

Frequent Co-Authors

Christoph Riplinger

Ragnar Bjornsson

Benedikt Orri Birgisson

Vilhjálmur Ásgeirsson