Jan-Michael Mewes
Jan-Michael Mewes
Mulliken Center for Theoretical Chemistry, Bonn University, Germany
Verified email at thch.uni-bonn.de
Title
Cited by
Cited by
Year
Experimental Benchmark Data and Systematic Evaluation of Two a Posteriori, Polarizable-Continuum Corrections for Vertical Excitation Energies in Solution
JM Mewes, ZQ You, M Wormit, T Kriesche, JM Herbert, A Dreuw
The Journal of Physical Chemistry A 119 (21), 5446-5464, 2015
1032015
On the molecular mechanism of non-radiative decay of nitrobenzene and the unforeseen challenges this simple molecule holds for electronic structure theory
JM Mewes, V Jovanović, CM Marian, A Dreuw
Physical Chemistry Chemical Physics 16 (24), 12393-12406, 2014
552014
On the accuracy of the general, state-specific polarizable-continuum model for the description of correlated ground-and excited states in solution
JM Mewes, JM Herbert, A Dreuw
Physical Chemistry Chemical Physics 19 (2), 1644-1654, 2017
522017
Excitons in poly (para phenylene vinylene): a quantum-chemical perspective based on high-level ab initio calculations
SA Mewes, JM Mewes, A Dreuw, F Plasser
Physical Chemistry Chemical Physics 18 (4), 2548-2563, 2016
482016
Quantum chemical excited state calculations on pigment–protein complexes require thorough geometry re-optimization of experimental crystal structures
A Dreuw, PHP Harbach, JM Mewes, M Wormit
Theoretical Chemistry Accounts 125 (3), 419-426, 2010
462010
Comparison of the Marcus and Pekar partitions in the context of non-equilibrium, polarizable-continuum solvation models
ZQ You, JM Mewes, A Dreuw, JM Herbert
The Journal of chemical physics 143 (20), 204104, 2015
432015
How Boron Doping Shapes the Optoelectronic Properties of Canonical and Phenylene‐Containing Oligoacenes: A Combined Experimental and Theoretical Investigation
S Kirschner, JM Mewes, M Bolte, HW Lerner, A Dreuw, M Wagner
Chemistry–A European Journal 23 (21), 5104-5116, 2017
292017
Excitation energy transfer and carotenoid radical cation formation in light harvesting complexes—A theoretical perspective
M Wormit, PHP Harbach, JM Mewes, S Amarie, J Wachtveitl, A Dreuw
Biochimica et Biophysica Acta (BBA)-Bioenergetics 1787 (6), 738-746, 2009
292009
Modeling TADF in organic emitters requires a careful consideration of the environment and going beyond the Franck–Condon approximation
JM Mewes
Physical Chemistry Chemical Physics 20 (18), 12454-12469, 2018
272018
Extension and evaluation of the D4 London-dispersion model for periodic systems
E Caldeweyher, JM Mewes, S Ehlert, S Grimme
Physical Chemistry Chemical Physics 22 (16), 8499-8512, 2020
252020
Mechanism of the photoinduced uncaging reaction of puromycin protected by a 6-nitroveratryloxycarbonyl group
J Kohl-Landgraf, F Buhr, D Lefrancois, JM Mewes, H Schwalbe, A Dreuw, ...
Journal of the American Chemical Society 136 (9), 3430-3438, 2014
232014
Solid oganesson via a many-body interaction expansion based on relativistic coupled-cluster theory and from plane-wave relativistic density functional theory
P Jerabek, OR Smits, JM Mewes, KA Peterson, P Schwerdtfeger
The Journal of Physical Chemistry A 123 (19), 4201-4211, 2019
182019
Oganesson Is a Semiconductor: On the Relativistic Band‐Gap Narrowing in the Heaviest Noble‐Gas Solids
JM Mewes, P Jerabek, OR Smits, P Schwerdtfeger
Angewandte Chemie International Edition 58 (40), 14260-14264, 2019
172019
Signatures and control of strong-field dynamics in a complex system
K Meyer, Z Liu, N Müller, JM Mewes, A Dreuw, T Buckup, M Motzkus, ...
Proceedings of the National Academy of Sciences 112 (51), 15613-15618, 2015
172015
r2SCAN-3c: A “Swiss army knife” composite electronic-structure method
S Grimme, A Hansen, S Ehlert, JM Mewes
The Journal of Chemical Physics 154 (6), 064103, 2021
152021
Charge-transfer states in triazole linked donor–acceptor materials: strong effects of chemical modification and solvation
P Kautny, F Glöcklhofer, T Kader, JM Mewes, B Stöger, J Fröhlich, ...
Physical Chemistry Chemical Physics 19 (27), 18055-18067, 2017
152017
BNB-Doped Phenalenyls: Modular Synthesis, Optoelectronic Properties, and One-Electron Reduction
AS Scholz, JG Massoth, M Bursch, JM Mewes, T Hetzke, B Wolf, M Bolte, ...
Journal of the American Chemical Society 142 (25), 11072-11083, 2020
142020
Copernicium: a relativistic noble liquid
JM Mewes, OR Smits, G Kresse, P Schwerdtfeger
Angewandte Chemie International Edition 58 (50), 17964-17968, 2019
142019
On the role of singlet versus triplet excited states in the uncaging of ortho-nitrobenzyl caged compounds
JM Mewes, A Dreuw
Physical Chemistry Chemical Physics 15 (18), 6691-6698, 2013
142013
The cohesive energy of superheavy element copernicium determined from accurate relativistic coupled-cluster theory
KG Steenbergen, JM Mewes, LF Pašteka, HW Gäggeler, G Kresse, E Pahl, ...
Physical Chemistry Chemical Physics 19 (48), 32286-32295, 2017
132017
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