Robin Grotjahn

TURBOMOLE: Modular program suite for <i>ab initio</i> quantum-chemical and condensed-matter simulations

Sree Ganesh Balasubramani, Guo P. Chen, Sonia Coriani et al. · The Journal of Chemical Physics · 2020 · 1.1K citations · Full text

A Local Hybrid Functional with Wide Applicability and Good Balance between (De)Localization and Left–Right Correlation

Matthias Haasler, Toni M. Maier, Robin Grotjahn et al. · Journal of Chemical Theory and Computation · 2020 · 102 citations

Development of a TDDFT-Based Protocol with Local Hybrid Functionals for the Screening of Potential Singlet Fission Chromophores

Robin Grotjahn, Toni M. Maier, Josef Michl et al. · Journal of Chemical Theory and Computation · 2017 · 76 citations · Full text

Full Implementation, Optimization, and Evaluation of a Range-Separated Local Hybrid Functional with Wide Accuracy for Ground and Excited States

Susanne Fürst, Matthias Haasler, Robin Grotjahn et al. · Journal of Chemical Theory and Computation · 2023 · 45 citations

Localized Excited State, Engineering, Rydberg Excitation Energies +17

Development and Implementation of Excited-State Gradients for Local Hybrid Functionals

Robin Grotjahn, Filipp Furche, Martin Kaupp · Journal of Chemical Theory and Computation · 2019 · 34 citations