Computational studies of rubber ozonation explain the effectiveness of 6PPD as an antidegradant and the mechanism of its quinone formation

E Rossomme, WM Hart-Cooper, WJ Orts… - … science & technology, 2023 - ACS Publications
The discovery that the commercial rubber antidegradant 6PPD reacts with ozone (O3) to
produce a highly toxic quinone (6PPDQ) spurred a significant research effort into nontoxic …

An Exploratory Flow Reactor Study of H2S Oxidation at 30–100 Bar

Y Song, H Hashemi, JM Christensen… - … Journal of Chemical …, 2017 - Wiley Online Library
Hydrogen sulfide oxidation experiments were conducted in O2/N2 at high pressure (30 and
100 bar) under oxidizing and stoichiometric conditions. Temperatures ranged from 450 to …

Thermal Reactions between H2S and O3: Implications for Europa Surface Chemistry

PD Tribbett, MJ Loeffler - The Planetary Science Journal, 2022 - iopscience.iop.org
Here we present a laboratory study demonstrating a low-temperature thermal oxidation
reaction within H 2 O+ H 2 S+ O 3 solid ice mixtures that produces observable sulfur anion …

H2S conversion in a tubular flow reactor: Experiments and kinetic modeling

JM Colom-Díaz, M Abián, MY Ballester, Á Millera… - Proceedings of the …, 2019 - Elsevier
Oxidation of H 2 S at atmospheric pressure has been studied under different reaction
atmospheres, varying the air excess ratio (λ) from reducing (λ= 0.32) to oxidizing conditions …

Gas-phase ozone reactions with a structurally diverse set of molecules: Barrier heights and reaction energies evaluated by coupled cluster and density functional …

D Trogolo, JS Arey, PR Tentscher - The Journal of Physical …, 2019 - ACS Publications
Reactions with ozone transform organic and inorganic molecules in water treatment systems
as well as in atmospheric chemistry, either in the aqueous phase, at gas/particle interfaces …

Experimental and Theoretical Kinetic Studies of the Ozonolysis of Selected Allyl Sulfides (H2C═CHCH2SR, R = CH3, CH3CH2): The Effect of Nascent OH …

AL Cardona, CB Rivela, RG Gibilisco… - The Journal of …, 2022 - ACS Publications
Rate coefficients of the O3-initiated oxidation of allyl methyl sulfide (H2C═ CHCH2SCH3,
AMS) and allyl ethyl sulfide (H2C═ CHCH2SCH2CH3, AES) were determined at …

[HTML][HTML] Sulfurous and sulfonic acids: Predicting the infrared spectrum and setting the surface straight

JP Misiewicz, KB Moore, PR Franke… - The Journal of …, 2020 - pubs.aip.org
Sulfurous acid (H 2 SO 3) is an infamously elusive molecule. Although some theoretical
papers have supposed possible roles for it in more complicated systems, it has yet to be …

Theoretical kinetics investigations of the reaction HO + SO ↔ H + SO2 on an accurate full‐dimensional potential energy surface

X Huang, J Qin, J Zhang, J Li - International Journal of …, 2023 - Wiley Online Library
Abstract The reaction HO+ SO→ H+ SO2 (Rt) and its reverse (R‐t) play an important role in
environment and the combustion of sulfur‐containing fuels. However, their kinetics is of high …

New results of H2S oxidation at high pressures. Experiments and kinetic modeling

JM Colom-Díaz, Á Millera, R Bilbao, MU Alzueta - Fuel, 2021 - Elsevier
The present study deals with the oxidation of H 2 S at high pressures. In some local
scenarios, combustion is seen as an alternative possibility for the use of sour gas mixtures …

A catalyst-free process for gas ozonation of reduced sulfur compounds

LV Pasetto, V Simon, R Richard, JS Pic… - Chemical Engineering …, 2020 - Elsevier
The feasibility of homogenous gas ozonation process was investigated in order to reduce
the negative environmental impact caused by reduced sulfur compounds (RSCs). Emitted …