Ab initio calculation of the MgO(100) interaction with He and Ne: a HF + MP2 and HF + MP2(B3LYP) comparison. (2011)

First Author: Martinez-Casado R
Attributed to:  Modelling of Advanced Functional Materials using Terascale Computing funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1039/c1cc14623h

PubMed Identifier: 21952116

Publication URI: http://europepmc.org/abstract/MED/21952116

Type: Journal Article/Review

Volume: 47

Parent Publication: Chemical communications (Cambridge, England)

Issue: 42

ISSN: 1359-7345