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Volumn 112, Issue 35, 2008, Pages 13650-13655

Electronic and magnetic properties of metal phthalocyanines on Au(111) surface: A first-principles study

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; ELECTRIC CONDUCTIVITY; ELECTRIC CURRENTS; ELECTRIC RESISTANCE; ELECTRONIC STRUCTURE; KONDO EFFECT; MAGNETIC MATERIALS; MAGNETIC PROPERTIES; MOLECULES; SOLID STATE PHYSICS; TRANSITION METALS;

EID: 52649088849     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp8043048     Document Type: Article
Times cited : (86)

References (44)
  • 34
    • 52649159385 scopus 로고    scopus 로고
    • We also perform some calculations using the Perdew-Burke-Enzerhof (PBE) GGA functional, but it may fail in correctly describing the electronic structures of some molecules, such as CuPc, which is also reported in ref 25. So we just take the LSDA results.
    • We also perform some calculations using the Perdew-Burke-Enzerhof (PBE) GGA functional, but it may fail in correctly describing the electronic structures of some molecules, such as CuPc, which is also reported in ref 25. So we just take the LSDA results.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.