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Title: Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case

Authors:
 [1]; ORCiD logo [2]; ORCiD logo [1]; ORCiD logo [1]
  1. Departament de Ciència de Materials i Química Física &, Institut de Química Teòrica i Computacional (IQTCUB), Universitat de Barcelona, C/Martí i Franquès 1, 08028 Barcelona, Spain
  2. Department of Chemistry, University of North Texas, Denton, Texas 76203-5017, USA
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1369481
Grant/Contract Number:  
Geosciences program at Pacific Northwest National Laboratory
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Name: Journal of Chemical Physics Journal Volume: 147 Journal Issue: 2; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Country of Publication:
United States
Language:
English

Citation Formats

Pueyo Bellafont, Noèlia, Bagus, Paul S., Sousa, Carmen, and Illas, Francesc. Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case. United States: N. p., 2017. Web. doi:10.1063/1.4991833.
Pueyo Bellafont, Noèlia, Bagus, Paul S., Sousa, Carmen, & Illas, Francesc. Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case. United States. doi:10.1063/1.4991833.
Pueyo Bellafont, Noèlia, Bagus, Paul S., Sousa, Carmen, and Illas, Francesc. Fri . "Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case". United States. doi:10.1063/1.4991833.
@article{osti_1369481,
title = {Assessing the ability of DFT methods to describe static electron correlation effects: CO core level binding energies as a representative case},
author = {Pueyo Bellafont, Noèlia and Bagus, Paul S. and Sousa, Carmen and Illas, Francesc},
abstractNote = {},
doi = {10.1063/1.4991833},
journal = {Journal of Chemical Physics},
number = 2,
volume = 147,
place = {United States},
year = {2017},
month = {7}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1063/1.4991833

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Cited by: 2 works
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