Publications of Alexandre Tkatchenko
All genres
Journal Article (101)
2008
Journal Article
78 (4), 045116 (2008)
Popular Kohn-Sham density functionals strongly overestimate many-body interactions in van der Waals systems. Physical Review B Talk (92)
2017
Talk
Approaches to van der Waals Interactions. Hands-on Workshop Density-Functional Theory and Beyond: Accuracy, Efficiency and Reproducibility in Computational Materials Science, Berlin, Germany (2017)
Talk
Competition for Active Sites in Steady State Catalytic Reactions; Importance of Weak Van Der Waals Interactions. 253rd ACS National Meeting & Exposition, Advanced Materials, Technologies, Systems & Processes, San Francisco, CA, USA (2017)
Talk
Electronic and Nuclear Quantum Fluctuations at the Nanoscale. 10th International Conference on Computational Physics (ICCP10), Macao, China (2017)
2016
Talk
A Primer on van der Waals Interactions and Quantum Fluctuations. IPAM Workshop on Understanding Many-Particle Systems with Machine Learning, Los Angeles, CA, USA (2016)
Talk
Accurate and Affordable Lattice Energy Calculations: A Solved Problem? 30th Meeting of the European Crystallographic Association, Basel, Switzerland (2016)
Talk
Non-Covalent van der Waals Interactions in Molecular Materials: A Solved Problem? Computational Chemistry, Gordon Research Conference, Girona, Spain (2016)
Talk
Seamless Dispersion Interactions for Molecules and Solids. Electronic Structure Theory with Numeric Atom-Centered Basis Functions, FHI-aims Developers' and Users' Meeting, Munich, Germany (2016)
Talk
Many-Body Dispersion: Dipole Limit and Beyond. CECAM Workshop, Density- and response density-based models for Intermolecular Interactions in Molecular Assemblies and in Solids, Nancy, France (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? BIOVIA Forum 2016, Noordwijk aan Zee, The Netherlands (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? 11th USPEX workshop, Villa Monastero, Varenna, Italy (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, Princeton University, Princeton, NJ, USA (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, École polytechnique fédérale de Lausanne (EPFL), Lausanne, Switzerland (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, Universidad Autonoma de Madrid (UAM), Madrid, Spain (2016)
Talk
Modeling Energy Efficient Catalysts from First Principles: Non-Covalent van der Waals Interactions. 251st ACS National Meeting & Exposition, Computers in Chemistry, San Diego, CA (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, Luxembourg Institute of Science and Technology (LIST), Luxembourg (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, Leiden University, Leiden, The Netherlands (2016)
Talk
Electronic Properties of Molecules and Materials with a Self-Consistent Interatomic van der Waals Density Functional. Total Energy and Force Methods 2016, University of Luxembourg, Luxembourg (2016)
Talk
Non-Covalent van der Waals Interactions in Molecules and Materials: A Solved Problem? Seminar, Technische Universität München, Munich, Germany (2016)
2015
Talk
Modeling Energetics and Dynamics of Molecules at Surfaces: Recent Advances and Remaining Challenges. Electronic Structure and Processes at Molecular-Based Interfaces
(ESPMI VIII), Tucson, AZ, USA (2015)