메뉴 건너뛰기




Volumn 108, Issue 20, 1998, Pages 8479-8484

Description of ligand field splitting in terms of density functional theory: Split levels of the lowest-lying subterms of the 4fn-16s2 (n=3-14) configurations in lanthanide monofluorides LnF (Ln=Pr-Yb)

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0039666107     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.476276     Document Type: Article
Times cited : (15)

References (24)
  • 2
    • 0003722464 scopus 로고    scopus 로고
    • edited by K. A. Gschneidner, Jr. and L. Eyring Elsevier, Amsterdam, Chap. 152
    • M. Dolg and H. Stoll, in Handbook on Physics and Chemistry of Rare Earths. Vol. 22, edited by K. A. Gschneidner, Jr. and L. Eyring (Elsevier, Amsterdam, 1996), Chap. 152.
    • (1996) Handbook on Physics and Chemistry of Rare Earths , vol.22
    • Dolg, M.1    Stoll, H.2
  • 3
    • 0003593328 scopus 로고
    • Cambridge University Press, New York
    • J. S. Griffith, The Theory of Transition-Metal Ions (Cambridge University Press, New York, 1961); K. König, and S. Kremer, Ligand Field Energy Diagrams (Plenum, New York, 1977).
    • (1961) The Theory of Transition-Metal Ions
    • Griffith, J.S.1
  • 4
    • 0003572299 scopus 로고
    • Plenum, New York
    • J. S. Griffith, The Theory of Transition-Metal Ions (Cambridge University Press, New York, 1961); K. König, and S. Kremer, Ligand Field Energy Diagrams (Plenum, New York, 1977).
    • (1977) Ligand Field Energy Diagrams
    • König, K.1    Kremer, S.2
  • 9
    • 84987068015 scopus 로고
    • C. Daul, Int. J. Quantum Chem. 52, 867 (1994); K. Bellafrouhm C. Daul, H. U. Güdel, F. Gilardoni, and J. Weber, Theor. Chim. Acta 91, 215 (1995).
    • (1994) Int. J. Quantum Chem. , vol.52 , pp. 867
    • Daul, C.1
  • 15
    • 0001151167 scopus 로고    scopus 로고
    • The list of all LFT parameters, together with the computed energy levels, was obtained from Professor L. A. Kaledin
    • A. L. Kaledin, M. C. Heaven, R. W. Field, and L. A. Kaledin, J. Mol. Spectrosc. 179, 310 (1996). The list of all LFT parameters, together with the computed energy levels, was obtained from Professor L. A. Kaledin.
    • (1996) J. Mol. Spectrosc. , vol.179 , pp. 310
    • Kaledin, A.L.1    Heaven, M.C.2    Field, R.W.3    Kaledin, L.A.4
  • 17
    • 0004066445 scopus 로고
    • Vrije Universiteit, Amsterdam
    • Amsterdam Density Functional (ADF), Theoretical Chemistry, Vrije Universiteit, Amsterdam, 1995.
    • (1995) Theoretical Chemistry
  • 23
    • 85034281825 scopus 로고    scopus 로고
    • note
    • See AIP Document No. PAPS JCPSA6-108-016820 for 14 pages of the results calculated for all LnF (Ln=Pr-Yb) compounds. Order by PAPS number and journal reference from American Institute of Physics, Physics Auxiliary Publication Service, Carolyn Gehlbach, 500 Sunnyside Boulevard, Woodbury, NY 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 pages. Airmail additional. Make checks payable to the American Institute of Physics.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.