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Volumn 21, Issue 4, 2010, Pages 847-854

First-principles study of electronic structure, absorption spectra, and thermodynamic properties of crystalline 1H-tetrazole and its substituted derivatives

(2) Zhu, Weihua a Xiao, Heming a

a NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY (China)

Author keywords

Absorption spectra; Band gaps; Density functional theory; Density of states; Thermodynamic properties

Indexed keywords

EID: 77954425302 PISSN: 10400400 EISSN: None Source Type: Journal
DOI: 10.1007/s11224-010-9619-5 Document Type: Article

Times cited : (19)

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