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Title: A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms

Authors:
ORCiD logo;
Publication Date:
Sponsoring Org.:
USDOE National Nuclear Security Administration (NNSA)
OSTI Identifier:
1547122
Grant/Contract Number:  
NA0002374
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Computer Physics Communications
Additional Journal Information:
Journal Name: Computer Physics Communications Journal Volume: 227 Journal Issue: C; Journal ID: ISSN 0010-4655
Publisher:
Elsevier
Country of Publication:
Netherlands
Language:
English

Citation Formats

Ghale, Purnima, and Johnson, Harley T. A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms. Netherlands: N. p., 2018. Web. doi:10.1016/j.cpc.2018.02.008.
Ghale, Purnima, & Johnson, Harley T. A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms. Netherlands. doi:https://doi.org/10.1016/j.cpc.2018.02.008
Ghale, Purnima, and Johnson, Harley T. Fri . "A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms". Netherlands. doi:https://doi.org/10.1016/j.cpc.2018.02.008.
@article{osti_1547122,
title = {A sparse matrix–vector multiplication based algorithm for accurate density matrix computations on systems of millions of atoms},
author = {Ghale, Purnima and Johnson, Harley T.},
abstractNote = {},
doi = {10.1016/j.cpc.2018.02.008},
journal = {Computer Physics Communications},
number = C,
volume = 227,
place = {Netherlands},
year = {2018},
month = {6}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: https://doi.org/10.1016/j.cpc.2018.02.008

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