Carlo Cavallotti
Affiliations: | Politecnico di Milano |
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Pratali Maffei L, Faravelli T, Cavallotti C, et al. (2020) Electronic structure-based rate rules for addition-elimination reactions on mono-aromatic hydrocarbons with single and double OH/CH/OCH/CHO/CH substituents: a systematic theoretical investigation. Physical Chemistry Chemical Physics : Pccp. 22: 20368-20387 |
Lupi J, Puzzarini C, Cavallotti C, et al. (2020) State-of-the-art quantum chemistry meets variable reaction coordinate transition state theory to solve the puzzling case of the HS + Cl system. Journal of Chemical Theory and Computation |
Puzzarini C, Salta Z, Tasinato N, et al. (2020) A twist on the reaction of the CN radical with methylamine in the interstellar medium: new hints from a state-of-the-art quantum-chemical study Monthly Notices of the Royal Astronomical Society. 496: 4298-4310 |
Stagni A, Cavallotti C, Arunthanayothin S, et al. (2020) An experimental, theoretical and kinetic-modeling study of the gas-phase oxidation of ammonia Reaction Chemistry and Engineering. 5: 696-711 |
Maffei LP, Pelucchi M, Faravelli T, et al. (2020) Theoretical study of sensitive reactions in phenol decomposition Reaction Chemistry and Engineering. 5: 452-472 |
Maffei LP, Cavallotti C, Caracciolo A, et al. (2020) Rate rules for the reactions of oxygen atoms with terminal alkenes Fuel. 263: 116536 |
Bai J, Cavallotti C, Zhou C. (2020) Theoretical kinetics analysis for ȮH radical addition to 1,3-butadiene and application to model prediction Combustion and Flame. 221: 228-240 |
Caracciolo A, Vanuzzo G, Balucani N, et al. (2019) Combined Experimental and Theoretical Studies of the O(P) + 1-Butene Reaction Dynamics: Primary Products, Branching Fractions, and Role of Intersystem Crossing. The Journal of Physical Chemistry. A. 123: 9934-9956 |
Caracciolo A, Vanuzzo G, Balucani N, et al. (2019) Crossed molecular beams and theoretical studies of the O(3P)+ 1,2-butadiene reaction: Dominant formation of propene+CO and ethylidene+ketene molecular channels Chinese Journal of Chemical Physics. 32: 113-122 |
Pelucchi M, Cavallotti C, Cuoci A, et al. (2019) Detailed kinetics of substituted phenolic species in pyrolysis bio-oils Reaction Chemistry and Engineering. 4: 490-506 |