Keywords = Density functional theory
Number of Articles: 2
1. Isomerism and Hydrogen Bonding in the Cis-enol Forms of 1-(n-pyridyl)butane-1,3-diones: A Theoretical Study

Volume 2, Issue 1, Winter 2016, Pages 43-56

Raheleh Afzali; Mohammad Vakili; Sayyed Faramarz Tayyari; Hossein Eshghi


2. DFT Study of the Six-Membered Heterocyclic SinN6-nHn (n = 0-6): Stability and Aromaticity

Volume 2, Issue 1, Winter 2016, Pages 70-80

Mehdi Nabati; Mehrdad Mahkam