Concepedia

Alexander Heck

AH

Statistics

Publications

9

Citations

594

H-Index

9

Active since

2012

Affiliations

Karlsruhe Institute of Technology(Current)

University College London

Heidelberg University

Technical University of Munich

Karlsruhe University of Education

Alexander Heck is an author at Karlsruhe Institute of Technology specializing in natural sciences, chemistry, and physics.

ORCID

Publications per year

2012–2021

9

Publications

9

Electronic couplings for molecular charge transfer: Benchmarking CDFT, FODFT, and FODFTB against high-level <i>ab initio</i> calculations

Adam Kubas, F. Hoffmann, Alexander Heck et al. · The Journal of Chemical Physics · 2014 · 199 citations

, , +17

Electronic couplings for molecular charge transfer: benchmarking CDFT, FODFT and FODFTB against high-level ab initio calculations. II

Adam Kubas, Fruzsina Gajdos, Alexander Heck et al. · Physical Chemistry Chemical Physics · 2014 · 133 citations

, , +16

Multi-Scale Approach to Non-Adiabatic Charge Transport in High-Mobility Organic Semiconductors

Alexander Heck, Julian Kranz, Tomáš Kubař et al. · Journal of Chemical Theory and Computation · 2015 · 74 citations

, , +17

Electronic Coupling Calculations for Bridge-Mediated Charge Transfer Using Constrained Density Functional Theory (CDFT) and Effective Hamiltonian Approaches at the Density Functional Theory (DFT) and Fragment-Orbital Density Functional Tight Binding (FODFTB) Level

Natacha Gillet, Laura Berstis, Xiaojing Wu et al. · Journal of Chemical Theory and Computation · 2016 · 56 citations · Full text

, , +16

Charge Transfer in Model Peptides: Obtaining Marcus Parameters from Molecular Simulation

Alexander Heck, P. Benjamin Woiczikowski, Tomáš Kubař et al. · The Journal of Physical Chemistry B · 2012 · 38 citations

, , +17

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