8 citations · 15 across the 2 of their papers we have counts for
4 papers
Diffraction of atomic matter waves through a 2D crystal
Carina Kanitz, Jakob Bühler, Vladimír Zobač +4
Diffraction of atoms from surfaces provides detailed insights into structures, interactions, and dynamical processes. However, currently the method is limited to measurements in re…
Ehrenfest dynamics with localized atomic-orbital basis sets within the projector augmented-wave method
Vladimír Zobač, Mikael Kuisma, Ask Hjorth Larsen +2
Density functional theory with linear combination of atomic orbitals (LCAO) basis sets is useful for studying large atomic systems, especially when it comes to computationally high…
Directionality in van der Waals Interactions: the Case of 4-Acetylbiphenyl Adsorbed on Au(111)
V. Zobac, R. Robles, N. Lorente
We report on a theoretical study of adsorption of 4-Acetylbiphenyl molecule and its diffusion properties in the main directions of the Au(111) surface. Structural changes of the mo…
Supramolecular Chemistry Based on 4-Acetylbiphenyl on Au(111)
Roberto Robles, Vladimír Zobač, Kwan Ho Au Yeung +3
On a gold surface, supramolecules composed of 4-acetylbiphenyl molecules show structural directionality, reproducibility and robustness to external perturbations. We investigate th…