메뉴 건너뛰기




Volumn 104, Issue 4, 2010, Pages

Large increase of the Curie temperature by orbital ordering control

Author keywords

[No Author keywords available]

Indexed keywords

APPROPRIATE MATERIALS; FIRST PRINCIPLE CALCULATIONS; GROWTH DIRECTIONS; ORBITAL ORDERING; ORDER OF MAGNITUDE; THEORETICAL PREDICTION;

EID: 75849156059     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.104.046804     Document Type: Article
Times cited : (102)

References (18)
  • 7
    • 10644250257 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.136.B864
    • P. Hohenberg and W. Kohn, Phys. Rev. PHRVAO 0031-899X 136, B864 (1964); 10.1103/PhysRev.136.B864
    • (1964) Phys. Rev. , vol.136 , pp. 864
    • Hohenberg, P.1    Kohn, W.2
  • 8
    • 0042113153 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.140.A1133
    • W. Kohn and L.J. Sham, Phys. Rev. 140, A1133 (1965). PHRVAO 0031-899X 10.1103/PhysRev.140.A1133
    • (1965) Phys. Rev. , vol.140 , pp. 1133
    • Kohn, W.1    Sham, L.J.2
  • 9
    • 0000189651 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.464913
    • A.D. Becke, J. Chem. Phys. 98, 5648 (1993); JCPSA6 0021-9606 10.1063/1.464913
    • (1993) J. Chem. Phys. , vol.98 , pp. 5648
    • Becke, A.D.1
  • 10
    • 0000053430 scopus 로고    scopus 로고
    • CHPLBC 0009-2614 10.1016/S0009-2614(01)00616-9
    • J. Muscat, A. Wander, and N.M. Harrison, Chem. Phys. Lett. CHPLBC 0009-2614 342, 397 (2001). 10.1016/S0009-2614(01)00616-9
    • (2001) Chem. Phys. Lett. , vol.342 , pp. 397
    • Muscat, J.1    Wander, A.2    Harrison, N.M.3
  • 13
    • 75849163740 scopus 로고    scopus 로고
    • Relativistic ECPs and associated basis sets are from the Stuttgart/Cologne Group
    • Relativistic ECPs and associated basis sets are from the Stuttgart/Cologne Group (www.theochem.uni-stuttgart.de/pseudopotentials and references therein). The basis sets have been reduced to 3ζ quality and exponents larger than 0.8 for Ti, O, and La, and larger than 0.11 for Ba and Mn. The precise ECPs are Ti4+ and Mn3+δ: ECP10MDF, Ba2+: ECP46MDF, O2-: ECP2SDF, La3+: ECP46MWB.
  • 17
    • 0009499934 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.100.545
    • E.O. Wollan and W.C. Koehler, Phys. Rev. 100, 545 (1955). PHRVAO 0031-899X 10.1103/PhysRev.100.545
    • (1955) Phys. Rev. , vol.100 , pp. 545
    • Wollan, E.O.1    Koehler, W.C.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.