Anisotropic van der Waals dispersion forces in polymers: Structural symmetry breaking leads to enhanced conformational search

The modeling of conformations and dynamics of (bio)polymers is of primary importance for understanding the physicochemical properties of soft matter. Although short-range interactions such as covalent and hydrogen bonding control the local arrangement of polymers, noncovalent interactions play a dom...

Full description

Bibliographic Details
Main Authors: Mario Galante, Alexandre Tkatchenko
Format: Article
Language:English
Published: American Physical Society 2023-02-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.5.L012028