skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Quantum many-body effects in x-ray spectra efficiently computed using a basic graph algorithm

Authors:
;
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1438503
Grant/Contract Number:  
AC02-05CH11231
Resource Type:
Journal Article: Publisher's Accepted Manuscript
Journal Name:
Physical Review B
Additional Journal Information:
Journal Name: Physical Review B Journal Volume: 97 Journal Issue: 20; Journal ID: ISSN 2469-9950
Publisher:
American Physical Society
Country of Publication:
United States
Language:
English

Citation Formats

Liang, Yufeng, and Prendergast, David. Quantum many-body effects in x-ray spectra efficiently computed using a basic graph algorithm. United States: N. p., 2018. Web. doi:10.1103/PhysRevB.97.205127.
Liang, Yufeng, & Prendergast, David. Quantum many-body effects in x-ray spectra efficiently computed using a basic graph algorithm. United States. doi:10.1103/PhysRevB.97.205127.
Liang, Yufeng, and Prendergast, David. Wed . "Quantum many-body effects in x-ray spectra efficiently computed using a basic graph algorithm". United States. doi:10.1103/PhysRevB.97.205127.
@article{osti_1438503,
title = {Quantum many-body effects in x-ray spectra efficiently computed using a basic graph algorithm},
author = {Liang, Yufeng and Prendergast, David},
abstractNote = {},
doi = {10.1103/PhysRevB.97.205127},
journal = {Physical Review B},
number = 20,
volume = 97,
place = {United States},
year = {Wed May 23 00:00:00 EDT 2018},
month = {Wed May 23 00:00:00 EDT 2018}
}

Journal Article:
Free Publicly Available Full Text
This content will become publicly available on May 23, 2019
Publisher's Accepted Manuscript

Save / Share:

Works referenced in this record:

Projector augmented-wave method
journal, December 1994


From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999


Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA+U study
journal, January 1998

  • Dudarev, S. L.; Botton, G. A.; Savrasov, S. Y.
  • Physical Review B, Vol. 57, Issue 3, p. 1505-1509
  • DOI: 10.1103/PhysRevB.57.1505

Electron correlation in semiconductors and insulators: Band gaps and quasiparticle energies
journal, October 1986


Soft self-consistent pseudopotentials in a generalized eigenvalue formalism
journal, April 1990


Design principles for oxygen-reduction activity on perovskite oxide catalysts for fuel cells and metal–air batteries
journal, June 2011

  • Suntivich, Jin; Gasteiger, Hubert A.; Yabuuchi, Naoaki
  • Nature Chemistry, Vol. 3, Issue 7, p. 546-550
  • DOI: 10.1038/nchem.1069