Jan Hermann
Jan Hermann
Verified email at fu-berlin.de - Homepage
Title
Cited by
Cited by
Year
First-Principles Models for van der Waals Interactions in Molecules and Materials: Concepts, Theory, and Applications
J Hermann, RA DiStasio Jr, A Tkatchenko
Chemical Reviews 117 (6), 4714–4758, 2017
2422017
Nanoscale π–π stacked molecules are bound by collective charge fluctuations
J Hermann, D Alfe, A Tkatchenko
Nature Communications 8, 14052, 2017
482017
Theoretical investigation of the Friedländer reaction catalysed by CuBTC: Concerted effect of the adjacent Cu²⁺ sites
M Položij, E Pérez-Mayoral, J Čejka, J Hermann, P Nachtigall
Catalysis Today 204, 101–107, 2013
272013
Theoretical investigation of layered zeolite frameworks: Surface properties of 2D zeolites
J Hermann, M Trachta, P Nachtigall, O Bludský
Catalysis Today 227, 2–8, 2014
222014
Electronic exchange and correlation in van der Waals systems: Balancing semilocal and nonlocal energy contributions
J Hermann, A Tkatchenko
Journal of Chemical Theory and Computation 14 (3), 1361-1369, 2018
202018
A novel correction scheme for DFT: A combined vdW-DF/CCSD(T) approach
J Hermann, O Bludský
The Journal of Chemical Physics 139 (3), 034115, 2013
152013
Deep neural network solution of the electronic Schrödinger equation
J Hermann, Z Schätzle, F Noé
arXiv:1909.08423, 2019
132019
Unifying Microscopic and Continuum Treatments of van der Waals and Casimir Interactions
PS Venkataram, J Hermann, A Tkatchenko, AW Rodriguez
Physical Review Letters 118, 266802, 2017
122017
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations
B Hourahine, B Aradi, V Blum, F Bonafe, A Buccheri, C Camacho, ...
The Journal of chemical physics 152 (12), 124101, 2020
92020
Communication: Many-body stabilization of non-covalent interactions: Structure, stability, and mechanics of Ag₃Co(CN)₆ framework
X Liu, J Hermann, A Tkatchenko
The Journal of Chemical Physics 145 (24), 241101, 2016
82016
Tuning Intermolecular Interactions with Nanostructured Environments
M Chattopadhyaya, J Hermann, I Poltavsky, A Tkatchenko
Chemistry of Materials 29 (6), 2452–2458, 2017
72017
Phonon-polariton mediated thermal radiation and heat transfer among molecules and macroscopic bodies: nonlocal electromagnetic response at mesoscopic scales
PS Venkataram, J Hermann, A Tkatchenko, AW Rodriguez
Physical Review Letters 121, 045901, 2018
62018
Recent developments in the PySCF program package
Q Sun, X Zhang, S Banerjee, P Bao, M Barbry, NS Blunt, NA Bogdanov, ...
arXiv preprint arXiv:2002.12531, 2020
22020
Impact of nuclear vibrations on van der Waals and Casimir interactions at zero and finite temperature
PS Venkataram, J Hermann, TJ Vongkovit, A Tkatchenko, AW Rodriguez
Science Advances 5 (11), eaaw0456, 2019
22019
Density Functional Model for van der Waals Interactions: Unifying Many-Body Atomic Approaches with Nonlocal Functionals
J Hermann, A Tkatchenko
Physical review letters 124 (14), 146401, 2020
12020
Towards unified density-functional model of van der Waals interactions
J Hermann
Humboldt University in Berlin, 2018
12018
van der Waals Interactions in Material Modelling
J Hermann, A Tkatchenko
Handbook of Materials Modeling, 1-33, 2018
12018
Coulomb Interactions between Dipolar Quantum Fluctuations in van der Waals Bound Molecules and Materials
M Stöhr, M Sadhukhan, YS Al-Hamdani, J Hermann, A Tkatchenko
arXiv preprint arXiv:2007.12505, 2020
2020
Introduction to Material Modeling
J Hermann
Machine Learning Meets Quantum Physics, 7-24, 2020
2020
Fluctuational Electrodynamics in Atomic and Macroscopic Systems: van der Waals Interactions and Radiative Heat Transfer
PS Venkataram, J Hermann, A Tkatchenko, AW Rodriguez
arXiv preprint arXiv:2005.04083, 2020
2020
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Articles 1–20