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Volumn 109, Issue 19, 1998, Pages 8374-8387

Diabatic analysis of the electronic states of hydrogen chloride

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0011400717     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.477500     Document Type: Article
Times cited : (26)

References (31)
  • 12
    • 21544444112 scopus 로고    scopus 로고
    • C)
    • C).
  • 14
    • 21544439278 scopus 로고    scopus 로고
    • For brevity, in Tables II and V the vibrational subscripts are omitted from the diagonal matrix elements, and the electronic subscripts are omitted from the off-diagonal ones
    • For brevity, in Tables II and V the vibrational subscripts are omitted from the diagonal matrix elements, and the electronic subscripts are omitted from the off-diagonal ones.
  • 16
    • 21544463669 scopus 로고    scopus 로고
    • Contrary to common usage in the treatment of off-diagonal spin-orbit matrix elements, evaluation of l-uncoupling Jṡl matrix elements in an atomic basis set requires special consideration. As discussed in Ref. 15, this difficulty arises from the fact that the centers of mass of the atom and molecule differ. Fortunately, for hydrides this origin-shifting effect is small, though not negligible
    • Contrary to common usage in the treatment of off-diagonal spin-orbit matrix elements, evaluation of l-uncoupling Jṡl matrix elements in an atomic basis set requires special consideration. As discussed in Ref. 15, this difficulty arises from the fact that the centers of mass of the atom and molecule differ. Fortunately, for hydrides this origin-shifting effect is small, though not negligible.
  • 17
    • 21544452496 scopus 로고    scopus 로고
    • + and b perturbation parameters
    • + and b perturbation parameters.
  • 20
    • 21544473378 scopus 로고    scopus 로고
    • See AIP Document No. PAPS JCPSA6-109-009839 for 22 pages of tables of diabatic state characters of the electronic states of HCl and DCl. Order by PAPS number and journal reference from American Institute of Physics, Physics Auxiliary Publications Service, 500 Sunnyside Boulevard, Woodbury, New York 11797-2999. Fax: 516-576-2223, e-mail: paps@aip.org. The price is $1.50 for each microfiche (98 pages) or $5.00 for photocopies of up to 30 pages, and $0.15 for each additional page over 30 copies. Airmail additional. Make checks payable to the American Institute of Physics
    • See AIP Document No. PAPS JCPSA6-109-009839 for 22 pages of tables of diabatic state characters of the electronic states of HCl and DCl. Order by PAPS number and journal reference from American Institute of Physics, Physics Auxiliary Publications Service, 500 Sunnyside Boulevard, Woodbury, New York 11797-2999. Fax: 516-576-2223, e-mail: paps@aip.org. The price is $1.50 for each microfiche (98 pages) or $5.00 for photocopies of up to 30 pages, and $0.15 for each additional page over 30 copies. Airmail additional. Make checks payable to the American Institute of Physics.
  • 28
    • 21544478714 scopus 로고    scopus 로고
    • + interaction; however, in that case Rydberg-valence mixing in the b state relaxes this restriction
    • + interaction; however, in that case Rydberg-valence mixing in the b state relaxes this restriction.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.