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Alexandre Tkatchenko

Showing results (41-50 of 199) with videos related to

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Chemical Society Reviews|June 14, 2019
Theory and practice of modeling van der Waals interactions in electronic-structure calculationsMartin Stöhr, Troy Van Voorhis, Alexandre Tkatchenko
The Journal of Chemical Physics|March 1, 2013
Interatomic methods for the dispersion energy derived from the adiabatic connection fluctuation-dissipation theoremAlexandre Tkatchenko, Alberto Ambrosetti, Robert A DiStasio
The Journal of Chemical Physics|March 17, 2018
Perturbed path integrals in imaginary time: Efficiently modeling nuclear quantum effects in molecules and materialsIgor Poltavsky, Robert A DiStasio, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|July 17, 2024
Four-Dimensional Scaling of Dipole Polarizability: From Single-Particle Models to Atoms and MoleculesSzabolcs Góger, Mohammad Reza Karimpour, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|October 24, 2023
Universal Pairwise Interatomic van der Waals Potentials Based on Quantum Drude OscillatorsAlmaz Khabibrakhmanov, Dmitry V Fedorov, Alexandre Tkatchenko
Chemical Reviews|March 9, 2017
First-Principles Models for van der Waals Interactions in Molecules and Materials: Concepts, Theory, and ApplicationsJan Hermann, Robert A DiStasio, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|May 12, 2018
Many-Body Descriptors for Predicting Molecular Properties with Machine Learning: Analysis of Pairwise and Three-Body Interactions in MoleculesWiktor Pronobis, Alexandre Tkatchenko, Klaus-Robert Müller
Journal of Chemical Theory and Computation|November 26, 2015
First-Principles Modeling of Non-Covalent Interactions in Supramolecular Systems: The Role of Many-Body EffectsAlexandre Tkatchenko, Dario Alfè, Kwang S Kim
The Journal of Physical Chemistry Letters|September 24, 2021
Fine-Structure Constant Connects Electronic Polarizability and Geometric van-der-Waals Radius of AtomsAlexandre Tkatchenko, Dmitry V Fedorov, Matteo Gori
The Journal of Physical Chemistry Letters|August 14, 2020
Accurate Many-Body Repulsive Potentials for Density-Functional Tight Binding from Deep Tensor Neural NetworksMartin Stöhr, Leonardo Medrano Sandonas, Alexandre Tkatchenko
Pageof 20

Showing results (41-50 of 199) with videos related to

Sort By:
Pageof 20
Chemical Society Reviews|June 14, 2019
Theory and practice of modeling van der Waals interactions in electronic-structure calculationsMartin Stöhr, Troy Van Voorhis, Alexandre Tkatchenko
The Journal of Chemical Physics|March 1, 2013
Interatomic methods for the dispersion energy derived from the adiabatic connection fluctuation-dissipation theoremAlexandre Tkatchenko, Alberto Ambrosetti, Robert A DiStasio
The Journal of Chemical Physics|March 17, 2018
Perturbed path integrals in imaginary time: Efficiently modeling nuclear quantum effects in molecules and materialsIgor Poltavsky, Robert A DiStasio, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|July 17, 2024
Four-Dimensional Scaling of Dipole Polarizability: From Single-Particle Models to Atoms and MoleculesSzabolcs Góger, Mohammad Reza Karimpour, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|October 24, 2023
Universal Pairwise Interatomic van der Waals Potentials Based on Quantum Drude OscillatorsAlmaz Khabibrakhmanov, Dmitry V Fedorov, Alexandre Tkatchenko
Chemical Reviews|March 9, 2017
First-Principles Models for van der Waals Interactions in Molecules and Materials: Concepts, Theory, and ApplicationsJan Hermann, Robert A DiStasio, Alexandre Tkatchenko
Journal of Chemical Theory and Computation|May 12, 2018
Many-Body Descriptors for Predicting Molecular Properties with Machine Learning: Analysis of Pairwise and Three-Body Interactions in MoleculesWiktor Pronobis, Alexandre Tkatchenko, Klaus-Robert Müller
Journal of Chemical Theory and Computation|November 26, 2015
First-Principles Modeling of Non-Covalent Interactions in Supramolecular Systems: The Role of Many-Body EffectsAlexandre Tkatchenko, Dario Alfè, Kwang S Kim
The Journal of Physical Chemistry Letters|September 24, 2021
Fine-Structure Constant Connects Electronic Polarizability and Geometric van-der-Waals Radius of AtomsAlexandre Tkatchenko, Dmitry V Fedorov, Matteo Gori
The Journal of Physical Chemistry Letters|August 14, 2020
Accurate Many-Body Repulsive Potentials for Density-Functional Tight Binding from Deep Tensor Neural NetworksMartin Stöhr, Leonardo Medrano Sandonas, Alexandre Tkatchenko
Pageof 20