Density functional theory calculations of large systems: Interplay between fragments, observables, and computational complexity (2021)
Attributed to:
Multi-Scale Framework for Quantum Mechanical Simulations of Organic Electronics
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1002/wcms.1574
Publication URI: http://dx.doi.org/10.1002/wcms.1574
Type: Journal Article/Review
Parent Publication: WIREs Computational Molecular Science
Issue: 3