QUASI-PARTICLE BAND-STRUCTURE OF CDS

Citation
M. Rohlfing et al., QUASI-PARTICLE BAND-STRUCTURE OF CDS, Physical review letters, 75(19), 1995, pp. 3489-3492
Citations number
27
Categorie Soggetti
Physics
Journal title
ISSN journal
00319007
Volume
75
Issue
19
Year of publication
1995
Pages
3489 - 3492
Database
ISI
SICI code
0031-9007(1995)75:19<3489:QBOC>2.0.ZU;2-B
Abstract
Quasiparticle band structure calculations which include the most impor tant cationic core states in the GW approximation of the self-energy o perator are reported for a prototype II-VI semiconductor. The most sal ient feature of our results for cubic CdS is the finding that the comp lete cationic N shell needs to be included in the pseudopotential and in the self-energy in order to obtain reasonable GW results in agreeme nt with experiment.