Materials and Molecular Modeling at the Exascale (2022)
Attributed to:
Transition metal controlled nitrogen chemistry in zeolite and protein environments using a unified quantum embedding model
funded by
EPSRC
Abstract
No abstract provided
Bibliographic Information
Digital Object Identifier: http://dx.doi.org/10.1109/mcse.2022.3141328
Publication URI: http://dx.doi.org/10.1109/mcse.2022.3141328
Type: Journal Article/Review
Parent Publication: Computing in Science & Engineering
Issue: 1