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Volumn 96, Issue 5, 2010, Pages

The absorption spectrum of hydrogenated silicon carbide nanocrystals from ab initio calculations

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; FIRST-PRINCIPLES CALCULATION; HYDROGENATED SILICON CARBIDE; RECONSTRUCTED SURFACES; ULTRA-SMALL;

EID: 76449120992     PISSN: 00036951     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3308495     Document Type: Article
Times cited : (38)

References (23)
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  • 15
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    • For this purpose the PWSCF code (Ref.) was applied with using standard ultrasoft pseudopotentials and 40 Ry plane wave cut-off.
    • For this purpose the PWSCF code (Ref.) was applied with using standard ultrasoft pseudopotentials and 40 Ry plane wave cut-off.
  • 17
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    • Hybrid functionals applied to extended systems
    • DOI 10.1088/0953-8984/20/6/064201, PII S0953898408638928
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    • Marsman, M.1    Paier, J.2    Stroppa, A.3    Kresse, G.4
  • 18
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  • 20
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    • See supplementary material at E-APPLAB-96-022006 for HMO states and density of states of selected SiC NCs.
    • See supplementary material at http://dx.doi.org/10.1063/1.3308495 E-APPLAB-96-022006 for HMO states and density of states of selected SiC NCs.
  • 21
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    • We note that the TDPBE and PBE gaps practically coincide with indicating unphysical vanishing exciton binding energies.
    • We note that the TDPBE and PBE gaps practically coincide with indicating unphysical vanishing exciton binding energies.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.