Prediction of a stable free standing nitrogen oligomer

Computational and Theoretical Chemistry

Volumn 966, Issue 1-3, 2011, Pages 137-139

  Owens, Frank J ^a  

^a CITY UNIVERSITY OF NEW YORK   (United States)

Author keywords

Band gap; Bond dissociation energy; Density functional theory; Energy output; Frequencies of normal modes; Nitrogen oligomer

Indexed keywords

EID: 84855165891     PISSN: 2210271X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.comptc.2011.02.026     Document Type: Article

References (10)

1. R. Engelke, J. Am. Chem. Soc. 115 (1993) 2961.
2. F.J. Owens, J. Mol. Struct. 623 (2003) 197.
3. M.I. Ermets et al., Nature Mater. 3 (2004) 558.
4. M.I. Ermets et al., J. Chem. Phys. 120 (2004) 10618.
5. H. Abou-Rachid et al., Phys. Rev. Lett. 100 (2008) 196401.
6. V. Timoshevshii et al., Phys. Rev. B80 (2009) 115409.
7. W. Ji et al., Appl. Phys. Lett. 95 (2009) 021904.
8. M.J. Frisch et al., Gaussian 03, Revision B.04.
9. M.S. Hybertsen, S.G. Louie, Phys. Rev. Lett. 55 (1985) 1418.
10. B.M. Rice, S. Sahu, F.J. Owens, J. Mol. Struct. 583 (2002) 69.