메뉴 건너뛰기




Volumn 91, Issue 15, 2003, Pages

Structural stability and optical properties of nanomaterials with reconstructed surfaces

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; MONTE CARLO METHODS; OPTICAL PROPERTIES; PHOTOLUMINESCENCE; POROUS SILICON; PROBABILITY DENSITY FUNCTION; STRUCTURE (COMPOSITION); SYNTHESIS (CHEMICAL);

EID: 3442887774     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.91.157405     Document Type: Article
Times cited : (154)

References (21)
  • 2
    • 85038309770 scopus 로고    scopus 로고
    • M. Roukes, Sci. Am. 285, No.�3, 48–57 (2001).
    • Sci. Am. , vol.285 , pp. 48-57
    • Roukes, M.1
  • 6
    • 4243675727 scopus 로고    scopus 로고
    • G. Allan et al, Phys. Rev. Lett. 76, 2961 (1996); 10.1103/PhysRevLett.76.2961
    • (1996) Phys. Rev. Lett. , vol.76 , pp. 2961
    • Allan, G.1
  • 7
  • 9
    • 85038292843 scopus 로고    scopus 로고
    • The GP code (F. Gygi, LLNL, 2002), with a plane wave basis (35�Ry cutoff) and norm-conserving pseudopotentials, was used for all DFT calculations. The LDA was used throughout. Representative clusters were compared with gradient corrected functionals, which produced negligible changes in the structural and optical properties.
    • (2002)
    • Gygi, F.1
  • 10
    • 0009542427 scopus 로고
    • G.P. Kerker, S.G. Louie, and M.L. Cohen, Phys. Rev. B10.1103/PhysRevB.17.706 17, 706 (1978).
    • (1978) Phys. Rev. B , vol.17 , pp. 706
  • 11
  • 12
    • 0034895704 scopus 로고    scopus 로고
    • F.A. Reboredo, S.B. Zhang, and A. Zunger, Phys. Rev. B 63, 125316 (2001).10.1103/PhysRevB.63.125316
    • (2001) Phys. Rev. B , vol.63 , pp. 125316
    • Zunger, A.1
  • 13
    • 85038319298 scopus 로고    scopus 로고
    • All QMC calculations were performed using the CASINO QMC code, version 1.5.4 User’s Manual (R. Needs et al, University of Cambridge, 2002).
    • (2002)
    • Needs, R.1
  • 14
    • 0001293662 scopus 로고    scopus 로고
    • P.R.C. Kent, R.Q. Hood, A.J. Williamson, R.J. Needs, W.M.C. Foulkes, and G. Rajagopal, Phys. Rev. B 59, 1917 (1999).10.1103/PhysRevB.59.1917
    • (1999) Phys. Rev. B , vol.59 , pp. 1917
    • Rajagopal, G.1
  • 16
    • 0000943087 scopus 로고    scopus 로고
    • J.P. Wilcoxon, G.A. Samara, and P.N. Provencio, Phys. Rev. B 60, 2704 (1999).10.1103/PhysRevB.60.2704
    • (1999) Phys. Rev. B , vol.60 , pp. 2704
  • 18
    • 0013318267 scopus 로고    scopus 로고
    • A.J. Williamson et al, Phys. Rev. Lett. 89, 196803 (2002), and references therein.10.1103/PhysRevLett.89.196803
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 196803
    • Williamson, A.J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.