Analysis of van der Waals density functional components: Binding and corrugation of benzene and C60on boron nitride and graphene
Author:
Publisher
American Physical Society (APS)
Subject
Condensed Matter Physics,Electronic, Optical and Magnetic Materials
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevB.87.205421/fulltext
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1. Density functional for van der Waals forces accounts for hydrogen bond in benchmark set of water hexamers
2. Ab Initio van der Waals Interactions in Simulations of Water Alter Structure from Mainly Tetrahedral to High-Density-Like
3. An application of the van der Waals density functional: Hydrogen bonding and stacking interactions between nucleobases
4. Towards a working density-functional theory for polymers: First-principles determination of the polyethylene crystal structure
5. Structure and binding in crystals of cagelike molecules: Hexamine and platonic hydrocarbons
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