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Volumn 249, Issue 23, 2005, Pages 2649-2660

Spin density distribution in transition metal complexes

Author keywords

Exchange coupling; Spin delocalization; Spin density; Spin polarization

Indexed keywords


EID: 27844536430     PISSN: 00108545     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ccr.2005.04.010     Document Type: Review
Times cited : (162)

References (52)
  • 12
    • 84967104236 scopus 로고    scopus 로고
    • J.S. Miller M. Drillon Wiley/VCH Weinheim
    • M. Gillon J.S. Miller M. Drillon Magnetism: Molecules to Materials vol. 1 2001 Wiley/VCH Weinheim 357 378
    • (2001) Magnetism: Molecules to Materials , vol.1 , pp. 357-378
    • Gillon, M.1
  • 13
    • 84967110193 scopus 로고    scopus 로고
    • J.S. Miller M. Drillon Wiley/VCH Weinheim
    • F. Kohler J.S. Miller M. Drillon Magnetism: Molecules to Materials vol. 1 2001 Wiley/VCH Weinheim 379 430
    • (2001) Magnetism: Molecules to Materials , vol.1 , pp. 379-430
    • Kohler, F.1
  • 38
    • 27844439795 scopus 로고    scopus 로고
    • note
    • The calculation of spin density shown was performed with the CPMD code (Car Parrinello Molecular Dynamics, version 3.7.2) with the hybrid B3LYP functional recently implemented in this code and using norm conserving pseudopotentials to account for core-valence interactions.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.