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Volumn 109, Issue 19, 2012, Pages

Na 2IrO 3 as a molecular orbital crystal

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC ORBITAL; DENSITY FUNCTIONAL THEORY CALCULATIONS; ORBITAL MOMENT; QUASIMOLECULAR ORBITALS; SPIN-ORBIT COUPLINGS;

EID: 84869025733     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.109.197201     Document Type: Article
Times cited : (213)

References (15)
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    • See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevLett.109.197201 for a detailed description of the electronic structure calculations, and of the derivation of the TB Hamiltonians.
  • 9
    • 84863230422 scopus 로고    scopus 로고
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    • C.H. Kim, H.S. Kim, H. Jeong, H. Jin, and J. Yu, Phys. Rev. Lett. 108, 106401 (2012). PRLTAO 0031-9007 10.1103/PhysRevLett.108.106401
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    • Spin dynamics can be in principle always mapped onto a localized spin model of a sufficient range, but this can be a dangerous exercise: compare the Fe pnictides, where such mapping led to an unphysically drastic temperature dependence of the Heisenberg exchange parameters, until it was realized that proper mapping requires a strong biquadratic term; see A.L. Wysocki, K.D. Belashchenko, and V.P. Antropov, Nat. Phys. 7, 485 (2011). NPAHAX 1745-2473 10.1038/nphys1933
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.