1.2k citations · 1.5k across the 4 of their papers we have counts for
4 papers
Van der Waals density functional: Self-consistent potential and the nature of the van der Waals bond
T. Thonhauser, Valentino R. Cooper, Shen Li +3
We derive the exchange-correlation potential corresponding to the nonlocal van der Waals density functional [M. Dion, H. Rydberg, E. Schroder, D. C. Langreth, and B. I. Lundqvist,…
Interaction energies of monosubstituted benzene dimers via nonlocal density functional theory
T. Thonhauser, Aaron Puzder, David C. Langreth
We present density-functional calculations for the interaction energy of monosubstituted benzene dimers. Our approach utilizes a recently developed fully nonlocal correlation energ…
Binding Energies in Benzene Dimers: Nonlocal Density Functional Calculations
Aaron Puzder, Maxime Dion, David C. Langreth
The interaction energy and minimum energy structure for different geometries of the benzene dimer has been calculated using the recently developed nonlocal correlation energy funct…
The Structure and Stokes Shift of Hydrogenated Silicon Nanoclusters
Lucas Wagner, Aaron Puzder, Andrew Williamson +5
We evaluate the optical gap and Stokes shift of several candidate 1 nm silicon nanocrystal structures using density functional and quantum Monte Carlo (QMC) methods. We find that t…