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Large-Scale Condensed Matter DFT Simulations: Performance and Capabilities of the CRYSTAL Code. (2017)

First Author: Erba A

Attributed to: Software Engineering - In Support of the Exascale funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1021/acs.jctc.7b00687

PubMed Identifier: 28873313

Publication URI: http://europepmc.org/abstract/MED/28873313

Type: Journal Article/Review

Volume: 13

Parent Publication: Journal of chemical theory and computation

Issue: 10

ISSN: 1549-9618