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Alexandre Tkatchenko

Researcher Next ID · RN-017054

Researcher · Materials Science

University of Luxembourg

, Luxembourg

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Not currently recruitingFunding unknown
Works count
529
Citation count
41,993
H-index
83
i10-index
214

Research interests

Materials Science
Physics and Astronomy
Computer Science
Machine Learning in Materials Science
Advanced Chemical Physics Studies
Computational Drug Discovery Methods
Quantum, superfluid, helium dynamics
Spectroscopy and Quantum Chemical Studies

Publications

  • SchNet – A deep learning architecture for molecules and materials

    The Journal of Chemical Physics · 2018 · 10.1063/1.5019779

  • Reproducibility in density functional theory calculations of solids

    Science · 2016 · 10.1126/science.aad3000

  • Fast and Accurate Modeling of Molecular Atomization Energies with Machine Learning

    Physical Review Letters · 2012 · 10.1103/physrevlett.108.058301

  • Accurate and Efficient Method for Many-Body van der Waals Interactions

    Physical Review Letters · 2012 · 10.1103/physrevlett.108.236402

  • Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data

    Physical Review Letters · 2009 · 10.1103/physrevlett.102.073005

Current projects

    No projects listed.