메뉴 건너뛰기




Volumn 20, Issue 1, 1999, Pages 106-113

Excitation energies of benzene from Kohn-Sham theory

Author keywords

Benzene; Density functional theory; Excited states

Indexed keywords


EID: 0001076306     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(19990115)20:1<106::AID-JCC11>3.0.CO;2-P     Document Type: Article
Times cited : (80)

References (26)
  • 1
    • 4243553426 scopus 로고
    • Becke, A. D. Phys Rev A 1988, 38, 3098; Lee, C.; Yang, W.; Parr, R. G. Phys Rev B 1988, 37, 785.
    • (1988) Phys Rev A , vol.38 , pp. 3098
    • Becke, A.D.1
  • 15
    • 0001473314 scopus 로고
    • but for H we use 0.35
    • Slater, J. C. J Chem Phys 1964, 41, 3199 (but for H we use 0.35).
    • (1964) J Chem Phys , vol.41 , pp. 3199
    • Slater, J.C.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.