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Physical Review Letters|July 15, 2017
Unifying Microscopic and Continuum Treatments of van der Waals and Casimir InteractionsPrashanth S Venkataram, Jan Hermann, Alexandre Tkatchenko, et al.
Physical Review Letters|April 8, 2011
Unraveling the stability of polypeptide helices: critical role of van der Waals interactionsAlexandre Tkatchenko, Mariana Rossi, Volker Blum, et al.
The Journal of Physical Chemistry Letters|January 4, 2018
Structure and Stability of Molecular Crystals with Many-Body Dispersion-Inclusive Density Functional Tight BindingMajid Mortazavi, Jan Gerit Brandenburg, Reinhard J Maurer, et al.
The Journal of Chemical Physics|June 10, 2018
Binding energies of benzene on coinage metal surfaces: Equal stability on different metalsFriedrich Maaß, Yingda Jiang, Wei Liu, et al.
Physical Review Letters|March 25, 2022
Colossal Enhancement of Atomic Force Response in van der Waals Materials Arising from Many-Body Electronic CorrelationsPaul Hauseux, Alberto Ambrosetti, Stéphane P A Bordas, et al.
Journal of Chemical Information and Modeling|April 8, 2026
aims-PAX: Parallel Active Exploration Enables Expedited Construction of Machine Learning Force Fields for Molecules and MaterialsTobias Henkes, Shubham Sharma, Alexandre Tkatchenko, et al.
Physical Review Letters|August 11, 2018
Phonon-Polariton Mediated Thermal Radiation and Heat Transfer among Molecules and Macroscopic Bodies: Nonlocal Electromagnetic Response at Mesoscopic ScalesPrashanth S Venkataram, Jan Hermann, Alexandre Tkatchenko, et al.
Nature Communications|November 15, 2017
Carbon nanotubes as excitonic insulatorsDaniele Varsano, Sandro Sorella, Davide Sangalli, et al.
The Journal of Physical Chemistry Letters|August 18, 2015
Size Effects in the Interface Level Alignment of Dye-Sensitized TiO2 ClustersNoa Marom, Thomas Körzdörfer, Xinguo Ren, et al.
Journal of Chemical Theory and Computation|April 20, 2026
Machine-Learned Electrostatic Potentials for Accurate Hydration Free Energy CalculationsMathias Hilfiker, Leonardo Medrano Sandonas, Alexandre Tkatchenko, et al.
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