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Volumn 46, Issue 21, 2007, Pages 8801-8811

Planar versus puckered nets in the polar intermetallic series EuGaTt (Tt = Si, Ge, Sn)

Author keywords

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Indexed keywords


EID: 35748984691     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic701111e     Document Type: Article
Times cited : (33)

References (57)
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  • 19
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    • SHELXTL, version 5.1; Bruker AXS Inc, Madison, WI, 1998
    • SHELXTL, version 5.1; Bruker AXS Inc.: Madison, WI, 1998.
  • 20
    • 0004204702 scopus 로고    scopus 로고
    • Clarendon Press: Oxford, U.K
    • Emsley, J. The Elements; Clarendon Press: Oxford, U.K., 1998.
    • (1998) The Elements
    • Emsley, J.1
  • 32
    • 35748972526 scopus 로고    scopus 로고
    • Jepsen, O, Burkhardt, A, Andersen, O. K. The TB-LMTO-ASA Program, version 4.7; Max-Planck-Institut für Festkörperforschung: Stuttgart, Germany, 1999
    • Jepsen, O.; Burkhardt, A.; Andersen, O. K. The TB-LMTO-ASA Program, version 4.7; Max-Planck-Institut für Festkörperforschung: Stuttgart, Germany, 1999.
  • 33
    • 35748948256 scopus 로고    scopus 로고
    • Kohout, M. BASIN, version 2.3; Max-Planck-Institut für Chemische Physik fester Stoffe: Dresden, Germany, 2001
    • Kohout, M. BASIN, version 2.3; Max-Planck-Institut für Chemische Physik fester Stoffe: Dresden, Germany, 2001.
  • 56
    • 35748953933 scopus 로고    scopus 로고
    • EHT calculations included orbital overlaps within second-nearest neighbor unit cell with Hamiltonian matrix elements calculated by the weighted Wolfsberg-Helmholz expression.51 Integrated COOP values were evaluated by 200 k-points in the first Brillouin zone. Atomic orbital parameters are as follows: Ga 4s, Hii, 14.58 eV, ζ, 1.77; Ga 4p, Hii, 6.75 eV, ζ, 1.55; Ge 4s, H ii, 16.00 eV, ζ, 2.16; Ge 4p, Hii, 9.00 eV, ζ, 1.85; Eu 6s, Hii, 8.13 eV, ζ, 1.74, Eu 6p, Hii, 5.13 eV, ζ, 1.70, Eu 5d, H ii, 8.32 eV, ζ1, 1.56 (0.8316, ζ2, 3.55 0.3041
    • 2 = 3.55 (0.3041).


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.