Density functional calculations on a double hydrogen bonded dimer of (p-methoxyphenyl)thiosemicarbazide

Polish Journal of Chemistry

Volumn 80, Issue 12, 2006, Pages 2031-2039

  Zhao, P S ^a   Li, R Q ^a   Zhang, L L ^a   Jian, F F ^b  

^a HUAIYIN NORMAL UNIVERSITY   (China)

^b QINGDAO UNIVERSITY OF SCIENCE AND TECHNOLOGY   (China)

Author keywords

Density functional theory; Hydrogen bonded dimer; Natural bond orbital; Thermodynamic properties

Indexed keywords

EID: 33846169696     PISSN: 01375083     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

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