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Volumn 215, Issue 1, 2002, Pages 42-57

A theoretical study of MgNC and MgCN in the X˜2ィ+ electronic state

Author keywords

ab initio; Electronic ground state; MgCN; MgNC; Rovibrational spectra

Indexed keywords

COMPUTER SIMULATION; ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; GROUND STATE; MOLECULAR VIBRATIONS; POTENTIAL ENERGY; SPECTROSCOPIC ANALYSIS;

EID: 0036026304     PISSN: 00222852     EISSN: None     Source Type: Journal    
DOI: 10.1006/jmsp.2002.8598     Document Type: Article
Times cited : (25)

References (38)
  • 24
    • 85007170511 scopus 로고    scopus 로고
    • MOLPRO2000 is a package of ab initio programs written by H.-J. Werner and P. J. Knowles, with contributions from R. D. Amos, A. Bernhardsson, A. Berning, P. Celani, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, T. Korona, R. Lindh, A. W. Lloyd, S. J. McNicholas, F. R. Manby, W. Meyer, M. E. Mura, A. Nick-lass, P. Palmieri, R. Pitzer, G. Rauhut, M. Schütz, H. Stoll, A. J. Stone, R. Tarroni, and T. Thorsteinsson
    • MOLPRO2000 is a package of ab initio programs written by H.-J. Werner and P. J. Knowles, with contributions from R. D. Amos, A. Bernhardsson, A. Berning, P. Celani, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, T. Korona, R. Lindh, A. W. Lloyd, S. J. McNicholas, F. R. Manby, W. Meyer, M. E. Mura, A. Nick-lass, P. Palmieri, R. Pitzer, G. Rauhut, M. Schütz, H. Stoll, A. J. Stone, R. Tarroni, and T. Thorsteinsson.
  • 29
    • 0004040140 scopus 로고
    • Department of Chemistry Report, University of Alberta, Edmonton, Alberta, Canada
    • S. Huzinaga, "Approximate Atomic Functions II." Department of Chemistry Report, University of Alberta, Edmonton, Alberta, Canada, 1971.
    • (1971) Approximate Atomic Functions II
    • Huzinaga, S.1
  • 32


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.