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The Journal of Chemical Physics|April 9, 2018
Anomalous van der Waals-Casimir interactions on graphene: A concerted effect of temperature, retardation, and non-localityAlberto Ambrosetti, Pier Luigi SilvestrelliThe Journal of Chemical Physics|April 5, 2014
Including screening in van der Waals corrected density functional theory calculations: the case of atoms and small molecules physisorbed on graphenePier Luigi Silvestrelli, Alberto AmbrosettiJournal of Chemical Theory and Computation|September 11, 2023
MBD + C: How to Incorporate Metallic Character into Atom-Based Dispersion Energy SchemesJohn F Dobson, Alberto AmbrosettiThe Journal of Chemical Physics|September 17, 2015
Many-body dispersion effects in the binding of adsorbates on metal surfacesReinhard J Maurer, Victor G Ruiz, Alexandre TkatchenkoThe Journal of Chemical Physics|June 6, 2018
Quantum tunneling of thermal protons through pristine grapheneIgor Poltavsky, Limin Zheng, Majid Mortazavi, et al.Journal of the American Chemical Society|October 31, 2024
A Gravitational-like Relationship of Dispersion Interactions is Exhibited by 40 Pairs of Molecules and Noble Gas AtomsDavid Danovich, Alexandre Tkatchenko, Santiago Alvarez, et al.Journal of the American Chemical Society|October 23, 2025
Noncovalent Interactions in Density Functional Theory: All the Charge Density We Do Not SeeAlmaz Khabibrakhmanov, Matteo Gori, Carolin Müller, et al.Journal of Chemical Theory and Computation|November 9, 2023
Selected Columns of the Density Matrix in an Atomic Orbital Basis I: An Intrinsic and Non-iterative Orbital Localization Scheme for the Occupied SpaceEric G Fuemmeler, Anil Damle, Robert A DiStasioJournal of Chemical Theory and Computation|November 15, 2021
Enabling Large-Scale Condensed-Phase Hybrid Density Functional Theory-Based Ab Initio Molecular Dynamics II: Extensions to the Isobaric-Isoenthalpic and Isobaric-Isothermal EnsemblesHsin-Yu Ko, Biswajit Santra, Robert A DiStasioJournal of Chemical Theory and Computation|November 29, 2015
Describing Both Dispersion Interactions and Electronic Structure Using Density Functional Theory: The Case of Metal-Phthalocyanine DimersNoa Marom, Alexandre Tkatchenko, Matthias Scheffler, et al.Pageof 26