Christoph R. Jacob, PhD
Affiliations: | 2010-2014 | Center for Functional Nanostructures | Karlsruher Institut für Technologie |
| 2014- | Theoretical Chemistry | TU Braunschweig, Braunschweig, Niedersachsen, Germany |
Website:
https://www.tu-braunschweig.de/pci/research/theorie/people/jacobGoogle:
"Christoph Jacob"Mean distance: (not calculated yet)
Parents
Sign in to add mentor| Lucas Visscher | grad student | 2004-2007 | VU Amsterdam |
| Markus Reiher | post-doc | 2008-2010 | ETH Zürich |
Children
Sign in to add trainee| Matthew D. Kundrat | post-doc | 2012-2014 | Karlsruher Institut für Technologie |
BETA: Related publications
See more...
Publications
|
You can help our author matching system! If you notice any publications incorrectly attributed to this author, please sign in and mark matches as correct or incorrect. |
| Brandenburg JG, Burke K, Civalleri B, et al. (2020) Challenges for large scale simulation: general discussion. Faraday Discussions |
| Brüggemann J, Jacob CR. (2020) Spin-state dependence of exchange-correlation holes. Faraday Discussions |
| De Santis M, Belpassi L, Jacob CR, et al. (2020) Environmental effects with Frozen Density Embedding in Real-Time Time-Dependent Density Functional Theory using localized basis functions. Journal of Chemical Theory and Computation |
| Saue T, Bast R, Gomes ASP, et al. (2020) The DIRAC code for relativistic molecular calculations. The Journal of Chemical Physics. 152: 204104 |
| Burkhardt L, Vukadinovic Y, Nowakowski M, et al. (2020) Electronic Structure of the Hieber Anion [Fe(CO)(NO)] Revisited by X-ray Emission and Absorption Spectroscopy. Inorganic Chemistry |
| Bergmann TG, Welzel MO, Jacob CR. (2020) Towards theoretical spectroscopy with error bars: systematic quantification of the structural sensitivity of calculated spectra Chemical Science. 11: 1862-1877 |
| Schulz A, Jacob CR. (2019) Description of intermolecular charge transfer with subsystem density-functional theory. The Journal of Chemical Physics. 151: 131103 |
| Zapata F, Ridder L, Hidding J, et al. (2019) QMflows: A Tool Kit for Interoperable Parallel Workflows in Quantum Chemistry. Journal of Chemical Information and Modeling |
| Panek PT, Hoeske AA, Jacob CR. (2019) On the choice of coordinates in anharmonic theoretical vibrational spectroscopy: Harmonic vs. anharmonic coupling in vibrational configuration interaction. The Journal of Chemical Physics. 150: 054107 |
| Reinartz I, Sinner C, Nettels D, et al. (2018) Simulation of FRET dyes allows quantitative comparison against experimental data. The Journal of Chemical Physics. 148: 123321 |