Sergiy I. Okovytyy

The Mechanism of Unimolecular Decomposition of 2,4,6,8,10,12-Hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane. A Computational DFT Study

Sergiy I. Okovytyy, Yana Kholod, Mohammad Qasim et al. · The Journal of Physical Chemistry A · 2005 · 106 citations

Natural Sciences, Chemistry, Computational Chemistry +13

Catalytic enantioselective synthesis of indanes by a cation-directed 5-endo-trig cyclization

Craig P. Johnston, Abhishek Kothari, Tetiana Sergeieva et al. · Nature Chemistry · 2015 · 94 citations

Natural Sciences, Chemistry, Medicinal Chemistry +14

An analysis of stable forms of CL-20: A DFT study of conformational transitions, infrared and Raman spectra

Yana Kholod, Sergiy I. Okovytyy, Mohammad Qasim et al. · Journal of Molecular Structure · 2007 · 91 citations

Natural Sciences, Chemistry, Physics +16

DFT M06-2X investigation of alkaline hydrolysis of nitroaromatic compounds

Frances C. Hill, Liudmyla K. Sviatenko, Leonid Gorb et al. · Chemosphere · 2012 · 64 citations

Natural Sciences, Chemistry, Catalysis +9

Comprehensive Investigations of Kinetics of Alkaline Hydrolysis of TNT (2,4,6-Trinitrotoluene), DNT (2,4-Dinitrotoluene), and DNAN (2,4-Dinitroanisole)

Liudmyla K. Sviatenko, Chad A. Kinney, Leonid Gorb et al. · Environmental Science & Technology · 2014 · 64 citations

Natural Sciences, Biochemistry, Chemistry +16