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

Title: LDA+U/GGA+U calculations of structural and electronic properties of CdTe: Dependence on the effective U parameter

Journal Article · · Computational Materials Science

Sponsoring Organization:
USDOE
Grant/Contract Number:
AC36-08GO28308
OSTI ID:
1250287
Journal Information:
Computational Materials Science, Journal Name: Computational Materials Science Vol. 98 Journal Issue: C; ISSN 0927-0256
Publisher:
ElsevierCopyright Statement
Country of Publication:
Netherlands
Language:
English
Citation Metrics:
Cited by: 17 works
Citation information provided by
Web of Science

Similar Records

DFT calculations of electronic and optical properties of SrS with LDA, GGA and mGGA functionals
Journal Article · Fri May 06 00:00:00 EDT 2016 · AIP Conference Proceedings · OSTI ID:1250287

The LDA+U calculation of electronic band structure of GaAs
Journal Article · Fri May 06 00:00:00 EDT 2016 · AIP Conference Proceedings · OSTI ID:1250287

Quantum Fluctuations in Fe{sub x}Mn{sub 1 –} {sub x}Si with Inclusion of the LDA + U + SO Calculations of the Electronic Structure
Journal Article · Mon Apr 15 00:00:00 EDT 2019 · Physics of the Solid State · OSTI ID:1250287

Related Subjects