Communication: Accurate higher-order van der Waals coefficients between molecules from a model dynamic multipole polarizability

Dynamical screening of van der Waals interactions in nanostructured solids: Sublimation of fullerenes

(2015) Jianmin Tao et al.   JOURNAL OF CHEMICAL PHYSICS

Van der Waals coefficients beyond the classical shell model

(2015) Jianmin Tao et al.   JOURNAL OF CHEMICAL PHYSICS

Reformulation of the D3(Becke–Johnson) Dispersion Correction without Resorting to Higher than C6 Dispersion Coefficients

(2015) Heiner Schröder et al.   Journal of Chemical Theory and Computation

Predicting Energetics of Supramolecular Systems Using the XDM Dispersion Model

(2015) A. Otero-de-la-Roza et al.   Journal of Chemical Theory and Computation

Communication: Non-additivity of van der Waals interactions between nanostructures

(2014) Jianmin Tao et al.   JOURNAL OF CHEMICAL PHYSICS

Role of Dispersive Interactions in Determining Structural Properties of Organic–Inorganic Halide Perovskites: Insights from First-Principles Calculations

(2014) David A. Egger et al.   Journal of Physical Chemistry Letters

Exchange functional that tests the robustness of the plasmon description of the van der Waals density functional

(2014) Kristian Berland et al.   PHYSICAL REVIEW B

Physical Adsorption: Theory of van der Waals Interactions between Particles and Clean Surfaces

(2014) Jianmin Tao et al.   PHYSICAL REVIEW LETTERS

LONG-RANGE VAN DER WAALS INTERACTION

(2013) JIANMIN TAO et al.   INTERNATIONAL JOURNAL OF MODERN PHYSICS B

Benchmarking of London Dispersion-Accounting Density Functional Theory Methods on Very Large Molecular Complexes

(2013) Tobias Risthaus et al.   Journal of Chemical Theory and Computation

Tkatchenko-Scheffler van der Waals correction method with and without self-consistent screening applied to solids

(2013) Tomáš Bučko et al.   PHYSICAL REVIEW B

A benchmark for non-covalent interactions in solids

(2012) A. Otero-de-la-Roza et al.   JOURNAL OF CHEMICAL PHYSICS

Graphite and Hexagonal Boron-Nitride have the Same Interlayer Distance. Why?

(2012) Oded Hod   Journal of Chemical Theory and Computation

An Assessment of the vdW-TS Method for Extended Systems

(2012) W. A. Al-Saidi et al.   Journal of Chemical Theory and Computation

Performance of meta-GGA Functionals on General Main Group Thermochemistry, Kinetics, and Noncovalent Interactions

(2012) Pan Hao et al.   Journal of Chemical Theory and Computation

Calculation of dispersion energies

(2012) John F Dobson et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Van der Waals Coefficients for Nanostructures: Fullerenes Defy Conventional Wisdom

(2012) Adrienn Ruzsinszky et al.   PHYSICAL REVIEW LETTERS

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

(2012) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

A generalized-gradient approximation exchange hole model for dispersion coefficients

(2011) Stephan N. Steinmann et al.   JOURNAL OF CHEMICAL PHYSICS

Comprehensive Benchmarking of a Density-Dependent Dispersion Correction

(2011) Stephan N. Steinmann et al.   Journal of Chemical Theory and Computation

A finite field method for calculating molecular polarizability tensors for arbitrary multipole rank

(2011) Dennis M. Elking et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Adhesion and electronic structure of graphene on hexagonal boron nitride substrates

(2011) B. Sachs et al.   PHYSICAL REVIEW B

Accurate van der Waals coefficients from density functional theory

(2011) J. Tao et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Electric dipole polarizabilities at imaginary frequencies for hydrogen, the alkali–metal, alkaline–earth, and noble gas atoms

(2010) Andrei Derevianko et al.   ATOMIC DATA AND NUCLEAR DATA TABLES

Van der Waals density functional from multipole dispersion interactions

(2010) Neemias Alves de Lima   JOURNAL OF CHEMICAL PHYSICS

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Long-range interaction for dimers of atmospheric interest: dispersion, induction and electrostatic contributions for O2O2, N2N2 and O2N2

(2010) Massimiliano Bartolomei et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Dispersion interactions from a local polarizability model

(2010) Oleg A. Vydrov et al.   PHYSICAL REVIEW A

Long-range van der Waals attraction and alkali-metal lattice constants

(2010) Jianmin Tao et al.   PHYSICAL REVIEW B

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

(2009) Alexandre Tkatchenko et al.   PHYSICAL REVIEW LETTERS

Local polarizabilities and dispersion energy coefficients

(2008) Richard Wheatley et al.   MOLECULAR PHYSICS