TY - GEN AU - Adamczyk,Paweł AU - Wijker,Reto S AU - Hofstetter,Thomas B AU - Paneth,Piotr TI - A DFT study of permanganate oxidation of toluene and its ortho-nitroderivatives SN - 0948-5023 PY - 2014///0919 KW - Air Pollution KW - Hydrogen KW - chemistry KW - Kinetics KW - Manganese Compounds KW - Nitrogen Compounds KW - Oxidation-Reduction KW - Oxides KW - Specific Gravity KW - Thermodynamics KW - Toluene N1 - Publication Type: Journal Article; Research Support, Non-U.S. Gov't UR - https://doi.org/10.1007/s00894-014-2091-1 ER -