Items where authors include "Shannon, RJ"

Article

McKee, K, Blitz, MA orcid.org/0000-0001-6710-4021, Shannon, RJ et al. (1 more author) (2022) HO2 + NO2: Kinetics, Thermochemistry, and Evidence for a Bimolecular Product Channel. The Journal of Physical Chemistry A, 126 (41). pp. 7514-7522. ISSN 1089-5639

Bodi, A, Burke, MP, Butler, AA et al. (33 more authors) (2022) Impact of Lindemann and related theories: general discussion. Faraday Discussions, 238. pp. 700-740. ISSN 1359-6640

Aerssens, J, Burke, MP, Cavallotti, C et al. (28 more authors) (2022) The master equation: general discussion. Faraday Discussions, 238. pp. 529-574. ISSN 1359-6640

Burke, MP, Casavecchia, P, Cavallotti, C et al. (32 more authors) (2022) The reaction step: general discussion. Faraday Discussions, 238. pp. 320-354. ISSN 1359-6640

Babikov, D, Burke, MP, Casavecchia, P et al. (28 more authors) (2022) Collisional energy transfer: general discussion. Faraday Discussions, 238. pp. 121-143. ISSN 1359-6640

Martínez‐Núñez, E, Barnes, GL, Glowacki, DR et al. (8 more authors) (2021) AutoMeKin2021 : An open‐source program for automated reaction discovery. Journal of Computational Chemistry, 42 (28). pp. 2036-2048. ISSN 0192-8651

Shannon, RJ orcid.org/0000-0002-1001-4065, Deeks, HM, Burfoot, E et al. (4 more authors) (2021) Exploring human-guided strategies for reaction network exploration: Interactive molecular dynamics in virtual reality as a tool for citizen scientists. The Journal of Chemical Physics, 155 (15). ISSN 0021-9606

Shannon, RJ, Martínez-Núñez, E, Shalashilin, DV orcid.org/0000-0001-6104-1277 et al. (1 more author) (2021) ChemDyME: Kinetically Steered, Automated Mechanism Generation through Combined Molecular Dynamics and Master Equation Calculations. Journal of Chemical Theory and Computation, 17 (8). pp. 4901-4912. ISSN 1549-9618

Shchepanovska, D, Shannon, RJ orcid.org/0000-0002-1001-4065, Curchod, BFE et al. (1 more author) (2021) Nonadiabatic Kinetics in the Intermediate Coupling Regime: Comparing Molecular Dynamics to an Energy-Grained Master Equation. The Journal of Physical Chemistry A, 125 (16). pp. 3473-3488. ISSN 1089-5639

Eskola, AJ, Blitz, MA orcid.org/0000-0001-6710-4021, Pilling, MJ et al. (2 more authors) (2020) Time-Resolved Measurements and Master Equation Modelling of the Unimolecular Decomposition of CH₃OCH₂. Zeitschrift für Physikalische Chemie, 234 (7-9). pp. 1233-1250. ISSN 0942-9352

Shannon, RJ, Amabilino, S, O'Connor, M et al. (2 more authors) (2018) Adaptively accelerating reactive molecular dynamics using boxed molecular dynamics in energy space. Journal of Chemical Theory and Computation, 14 (9). pp. 4541-4552. ISSN 1549-9618

Shannon, RJ, Gómez Martín, JC orcid.org/0000-0001-7972-085X, Caravan, RL et al. (11 more authors) (2018) Comment on “Methanol dimer formation drastically enhances hydrogen abstraction from methanol by OH at low temperature” by W. Siebrand, Z. Smedarchina, E. Martínez-Núñez and A. Fernández-Ramos, Phys. Chem. Chem. Phys., 2016, 18, 22712. Physical Chemistry Chemical Physics, 20 (12). pp. 8349-8354. ISSN 1463-9076

Howes, NUM, Lockhart, JPA, Blitz, MA orcid.org/0000-0001-6710-4021 et al. (6 more authors) (2016) Observation of a New Channel, the Production of CH3, in the Abstraction Reaction of OH Radicals with Acetaldehyde. Physical Chemistry Chemical Physics, 18 (38). pp. 26423-26433. ISSN 1463-9076

Shannon, RJ, Robertson, SH, Blitz, MA et al. (1 more author) (2016) Bimoloacular Reactions of Activated Species: An Analysis of Problematic HC(O)C(O) chemistry. Chemical Physics Letters, 661. pp. 58-64. ISSN 0009-2614

Caravan, RL, Shannon, RJ, Lewis, T et al. (2 more authors) (2015) Measurements of Rate Coefficients for Reactions of OH with Ethanol and Propan-2-ol at Very Low Temperatures. Journal of Physical Chemistry A, 119 (28). 7130 - 7137. ISSN 1089-5639

Blitz, MA, Green, NJB, Shannon, RJ et al. (4 more authors) (2015) Reanalysis of rate data for the reaction CH3 + CH3 → C2H6 using revised cross sections and a linearized second-order master equation. Journal of Physical Chemistry A, 119 (28). 7668 - 7682. ISSN 1089-5639

Acharyya, K, Herbst, E, Caravan, RL et al. (3 more authors) (2015) The importance of OH radical–neutral low temperature tunnelling reactions in interstellar clouds using a new model. Molecular Physics, 113 (15-16). 2243 - 2254. ISSN 0026-8976

Eskola, AJ, Carr, SA, Shannon, RJ et al. (5 more authors) (2014) Analysis of the kinetics and yields of OH radical production from the CH₃OCH₂ + O₂ reaction in the temperature range 195-650 K: an experimental and computational study. Journal of Physical Chemistry A, 118 (34). pp. 6773-6788. ISSN 1089-5639

Shannon, RJ, Caravan, RL, Blitz, MA et al. (1 more author) (2014) A combined experimental and theoretical study of reactions between the hydroxyl radical and oxygenated hydrocarbons relevant to astrochemical environments. Physical Chemistry Chemical Physics, 16 (8). 3466 - 3478. ISSN 1463-9076

Shannon, RJ, Blitz, MA, Goddard, A et al. (1 more author) (2013) Accelerated chemistry in the reaction between the hydroxyl radical and methanol at interstellar temperatures facilitated by tunnelling. Nature Chemistry, 5 (9). 745 - 749. ISSN 1755-4330

Lockhart, J, Blitz, MA, Heard, DE et al. (2 more authors) (2013) Mechanism of the reaction of OH with alkynes in the presence of oxygen. Journal of Physical Chemistry A, 117 (26). 5407 - 5418. ISSN 1089-5639