Frank Neese

Researcher Next ID · RN-001806

Researcher · Materials Science

Munich, Germany

Not currently recruitingFunding unknown

Research interests

Materials Science

Physics and Astronomy

Chemistry

Magnetism in coordination complexes

Advanced Chemical Physics Studies

Metal-Catalyzed Oxygenation Mechanisms

X-ray Diffraction in Crystallography

Crystallization and Solubility Studies

Software update: The ORCA program system—Version 5.0
Wiley Interdisciplinary Reviews Computational Molecular Science · 2022 · https://doi.org/10.1002/wcms.1606
The ORCA quantum chemistry program package
The Journal of Chemical Physics · 2020 · https://doi.org/10.1063/5.0004608
Software update: the ORCA program system, version 4.0
Wiley Interdisciplinary Reviews Computational Molecular Science · 2017 · https://doi.org/10.1002/wcms.1327
The ORCA program system
Wiley Interdisciplinary Reviews Computational Molecular Science · 2011 · https://doi.org/10.1002/wcms.81
Efficient, approximate and parallel Hartree–Fock and hybrid DFT calculations. A ‘chain-of-spheres’ algorithm for the Hartree–Fock exchange
Chemical Physics · 2008 · https://doi.org/10.1016/j.chemphys.2008.10.036

No projects listed.