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Volumn 149, Issue 21-22, 2009, Pages 847-851

Two-leg spin ladder model for Ag2VOP2O7 from mapping analysis based on first principles density functional calculations

Author keywords

A. Ag2V OP2O7; B. Exchange and superexchange interactions; D. Spin ladder

Indexed keywords

A. AG2V OP2O7; ANTIFERRO-MAGNETIC INTERACTIONS; B. EXCHANGE AND SUPEREXCHANGE INTERACTIONS; D. SPIN LADDER; FIRST-PRINCIPLES DENSITY FUNCTIONAL CALCULATIONS; FIRST-PRINCIPLES DENSITY FUNCTIONAL THEORIES; MAPPING ANALYSIS; SPIN DIMER ANALYSIS; SPIN DIMERS; SPIN EXCHANGES; SPIN FRUSTRATIONS; SPIN-EXCHANGE INTERACTIONS; SUPEREXCHANGE; TIGHT-BINDING CALCULATIONS; TWO-LEG SPIN LADDERS;

EID: 65349084886     PISSN: 00381098     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ssc.2009.03.017     Document Type: Article
Times cited : (1)

References (33)
  • 15
    • 65349142165 scopus 로고    scopus 로고
    • Our calculations were carried out by employing the SAMOA (Structure and Molecular Orbital Analyzer) program package This program can be downloaded free of charge from the website
    • Our calculations were carried out by employing the SAMOA (Structure and Molecular Orbital Analyzer) program package (This program can be downloaded free of charge from the website, http://chvamw.chem.ncsu.edu/)
  • 24
    • 65349092181 scopus 로고    scopus 로고
    • We have used three spin exchange paths J1, J3 to extract J parameters based on first principles DFT band structure calculations since the remaining spin exchange interactions are negligible
    • 3 to extract J parameters based on first principles DFT band structure calculations since the remaining spin exchange interactions are negligible


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.