Lithium-doped (4,4) Boron nitride nanotube: Density functional theory study of N and B nuclear magnetic shielding and electric field gradient tensors

Journal of Molecular Structure: THEOCHEM

Volumn 895, Issue 1-3, 2009, Pages 82-85

  Seif, Ahmad ^a   Boshra, Asadollah ^a   Seif, Majid ^a  

^a Department of Chemistry   (Iran)

Author keywords

DFT; GIAO; Li doped Boron nitride nanotube; Nuclear magnetic shielding; Quadrupole coupling constant

Indexed keywords

EID: 58649113409     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.10.028     Document Type: Article

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