Density functional calculations of the electronic structure of 3-phenylamino-4-phenyl-1,2,4-triazole-5-thione

Ali Hussain Reshak, Dalibor Stys, S. Auluck, I. V. Kityk
  • Physical Chemistry Chemical Physics, January 2010, Royal Society of Chemistry
  • DOI: 10.1039/b920743k