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Volumn 63, Issue 21, 2001, Pages

Proposal of an extended (formula presented) Hamiltonian for high-(formula presented) cuprates from ab initio calculations on embedded clusters

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EID: 85038279881     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.63.214520     Document Type: Article
Times cited : (3)

References (73)
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    • For metallic atoms, the ab initio relativistic core model potential proposed by Barandiarán [Z. Barandiarán and L. Seijo, Can. J. Phys. 70, 409 (1992)] has been used, where the Cu valence electrons are described by a (Formula presented) basis set. For the oxygen atoms, an all electron basis set (Formula presented) contracted to (Formula presented) is employed
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    • Barandiarán, Z.1    Seijo, L.2
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    • K. Andersson, M. R. A. Blomberg, M. P. Fülscher, G. Karlström, R. Lindh, P. A. Malmqvist, P. Neogrády, J. Olsen, B. O. Roos, A. J. Sadlej, M. Schütz, L. Seijo, L. Serrano-Andrés, P. E. M. Siegbahn, and P. O. Widmark, MOLCAS version 4, Lund University, Sweden, 1997
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.