메뉴 건너뛰기




Volumn 98, Issue 17, 2007, Pages

Charge ordering as alternative to Jahn-Teller distortion

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; INSULATING MATERIALS; NICKEL COMPOUNDS; QUANTUM THEORY; RARE EARTH COMPOUNDS;

EID: 34247571513     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.98.176406     Document Type: Article
Times cited : (306)

References (16)
  • 1
    • 0001130730 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.64.094102
    • J.A. Alonso, Phys. Rev. B PRBMDO 0163-1829 64, 094102 (2001). 10.1103/PhysRevB.64.094102
    • (2001) Phys. Rev. B , vol.64 , pp. 094102
    • Alonso, J.A.1
  • 3
    • 0001088066 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.82.3871
    • J.A. Alonso, Phys. Rev. Lett. 82, 3871 (1999). PRLTAO 0031-9007 10.1103/PhysRevLett.82.3871
    • (1999) Phys. Rev. Lett. , vol.82 , pp. 3871
    • Alonso, J.A.1
  • 4
    • 0037171207 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.88.126402
    • U. Staub, Phys. Rev. Lett. 88, 126402 (2002). PRLTAO 0031-9007 10.1103/PhysRevLett.88.126402
    • (2002) Phys. Rev. Lett. , vol.88 , pp. 126402
    • Staub, U.1
  • 5
    • 0035477132 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.64.144417
    • M.T. Fernández-Díaz, Phys. Rev. B PRBMDO 0163-1829 64, 144417 (2001). 10.1103/PhysRevB.64.144417
    • (2001) Phys. Rev. B , vol.64 , pp. 144417
    • Fernández-Díaz, M.T.1
  • 6
    • 34247585744 scopus 로고    scopus 로고
    • Technische Universität Wien, Austria
    • P. Blaha, computer code WIEN2k, Technische Universität Wien, Austria, 2001;
    • (2001)
    • Blaha, P.1
  • 7
    • 34247629709 scopus 로고    scopus 로고
    • The cutoff parameter RKmax=7, with local orbitals and the augmented plane wave (APW) extension was used. For the local density approximation (LDA)+U approach we took U=5eV and J=1eV. For most self-consistent calculations 54 inequivalent k points in the fourfolded Brillouin zone were utilized; meshes with up to ∼1000 inequivalent points were used for testing and for analyzing the DOS. Gradient corrections were included in all calculations.
    • The cutoff parameter RKmax=7, with local orbitals and the augmented plane wave (APW) extension was used. For the local density approximation (LDA)+U approach we took U=5eV and J=1eV. For most self-consistent calculations 54 inequivalent k points in the fourfolded Brillouin zone were utilized; meshes with up to ∼1000 inequivalent points were used for testing and for analyzing the DOS. Gradient corrections were included in all calculations.
  • 8
    • 2142642297 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.69.094106
    • J.L. García-Muñoz, Phys. Rev. B PRBMDO 0163-1829 69, 094106 (2004). 10.1103/PhysRevB.69.094106
    • (2004) Phys. Rev. B , vol.69 , pp. 094106
    • García-Muñoz, J.L.1
  • 9
    • 0001132637 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.45.8209
    • J.B. Torrance, Phys. Rev. B PRBMDO 0163-1829 45, 8209 (1992). 10.1103/PhysRevB.45.8209
    • (1992) Phys. Rev. B , vol.45 , pp. 8209
    • Torrance, J.B.1
  • 10
    • 42749099658 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.69.153105
    • J.-S. Zhou and J.B. Goodenough, Phys. Rev. B PRBMDO 0163-1829 69, 153105 (2004). 10.1103/PhysRevB.69.153105
    • (2004) Phys. Rev. B , vol.69 , pp. 153105
    • Zhou, J.-S.1    Goodenough, J.B.2
  • 11
    • 0001074719 scopus 로고
    • JSSCBI 0022-4596 10.1016/0022-4596(71)90105-8
    • G. Demazeau, J. Solid State Chem. 3, 582 (1971). JSSCBI 0022-4596 10.1016/0022-4596(71)90105-8
    • (1971) J. Solid State Chem. , vol.3 , pp. 582
    • Demazeau, G.1
  • 12
    • 27144465232 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.95.127204
    • J.-S. Zhou, Phys. Rev. Lett. 95, 127204 (2005). PRLTAO 0031-9007 10.1103/PhysRevLett.95.127204
    • (2005) Phys. Rev. Lett. , vol.95 , pp. 127204
    • Zhou, J.-S.1
  • 13
    • 2942653150 scopus 로고    scopus 로고
    • JCOMEL 0953-8984 10.1088/0953-8984/16/20/006
    • R. Lengsdorf, J. Phys. Condens. Matter JCOMEL 0953-8984 16, 3355 (2004). 10.1088/0953-8984/16/20/006
    • (2004) J. Phys. Condens. Matter , vol.16 , pp. 3355
    • Lengsdorf, R.1
  • 14
    • 0017537036 scopus 로고
    • MRBUAC 0025-5408 10.1016/0025-5408(77)90104-0
    • M. Takano, Mater. Res. Bull. MRBUAC 0025-5408 12, 923 (1977). 10.1016/0025-5408(77)90104-0
    • (1977) Mater. Res. Bull. , vol.12 , pp. 923
    • Takano, M.1
  • 15
    • 0034360229 scopus 로고    scopus 로고
    • JUPSAU 0031-9015 10.1143/JPSJ.69.2767
    • K. Kuzushita, J. Phys. Soc. Jpn. 69, 2767 (2000). JUPSAU 0031-9015 10.1143/JPSJ.69.2767
    • (2000) J. Phys. Soc. Jpn. , vol.69 , pp. 2767
    • Kuzushita, K.1
  • 16
    • 34247576858 scopus 로고    scopus 로고
    • Ph.D. thesis, Universidad del Pais Vasco, Bilbao, Spain
    • M. Amboage, Ph.D. thesis, Universidad del Pais Vasco, Bilbao, Spain, 2003.
    • (2003)
    • Amboage, M.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.