Computational and Theoretical Chemistry Journal

Overview

publication venue for

• Theoretical study of insertion of thiophene and novel pyridoquinazolinone-containing on the photoelectric properties of triphenylamine dye molecules 2024
• Real-space quasi-relativistic quantum chemistry 2020
• An atmospherically relevant acid: HNO3 2011
• Ab initio study of H₂SO₄ rotamers 2004
• HFF: a force field for liquid crystal molecules 1999

Research

keywords

• 0306 Physical Chemistry (incl. Structural), 0307 Theoretical and Computational Chemistry