Atmospheric chemistry of the self-reaction of HO 2 radicals: Stepwise mechanism versus one-step process in the presence of (H 2 O) n (n= 1–3) clusters T Zhang, M Wen, Y Zhang, X Lan, B Long, R Wang, X Yu, C Zhao, ... Physical Chemistry Chemical Physics 21 (43), 24042-24053, 2019 | 24 | 2019 |
Kinetic modeling of CL-20 decomposition by a chemical reaction neural network H Wang, Y Xu, M Wen, W Wang, Q Chu, S Yan, S Xu, D Chen Journal of Analytical and Applied Pyrolysis 169, 105860, 2023 | 12 | 2023 |
The hydrolysis of NO2 dimer in small clusters of sulfuric acid: A potential source of nitrous acid in troposphere T Zhang, M Wen, X Cao, Y Zhang, Z Zeng, X Guo, C Zhao, M Lily, R Wang Atmospheric Environment 243, 117876, 2020 | 10 | 2020 |
Reaction Network of Ammonium Perchlorate (AP) Decomposition: The Missing Piece from Atomic Simulations Q Chu, M Wen, X Fu, A Eslami, D Chen The Journal of Physical Chemistry C 127 (27), 12976-12982, 2023 | 9 | 2023 |
Effects of water, ammonia and formic acid on HO 2+ Cl reactions under atmospheric conditions: competition between a stepwise route and one elementary step T Zhang, Y Zhang, M Wen, Z Tang, B Long, X Yu, C Zhao, W Wang RSC advances 9 (37), 21544-21556, 2019 | 9 | 2019 |
Atmospheric Chemistry of CH2OO: The Hydrolysis of CH2OO in Small Clusters of Sulfuric Acid R Wang, M Wen, X Chen, R Mu, Z Zeng, G Chai, M Lily, Z Wang, T Zhang The Journal of Physical Chemistry A 125 (12), 2642-2652, 2021 | 7 | 2021 |
The favorable routes for the hydrolysis of CH 2 OO with (H 2 O) n (n= 1–4) investigated by global minimum searching combined with quantum chemical methods R Wang, M Wen, S Liu, Y Lu, L Makroni, B Muthiah, T Zhang, Z Wang, ... Physical Chemistry Chemical Physics 23 (22), 12749-12760, 2021 | 7 | 2021 |
Multiple evaluations of atmospheric behavior between Criegee intermediates and HCHO: Gas-phase and air-water interface reaction T Zhang, M Wen, C Ding, Y Zhang, X Ma, Z Wang, M Lily, J Liu, R Wang Journal of Environmental Sciences 127, 308-319, 2023 | 6 | 2023 |
Catalytic effect of water, water dimer, HCOOH and H2SO4 on the isomerisation of HON(O)NNO2 to ON(OH)NNO2: a mechanism study T Zhang, X Lan, M Wen, Y Zhang, R Wang, Z Wang Molecular Simulation 44 (18), 1544-1553, 2018 | 6 | 2018 |
The HO4H → O3 + H2O reaction catalysed by acidic, neutral and basic catalysts in the troposphere T Zhang, X Bi, M Wen, S Liu, G Chai, Z Zeng, R Wang, W Wang, B Long Molecular Physics 118 (12), e1673912, 2020 | 5 | 2020 |
A potential source of tropospheric secondary organic aerosol precursors: The hydrolysis of N2O5 in water dimer and small clusters of sulfuric acid M Wen, R Li, T Zhang, C Ding, Y Hu, R Mu, M Liang, T Ou, B Long Atmospheric Environment 287, 119245, 2022 | 4 | 2022 |
Effect of NH 3 and HCOOH on the H 2 O 2+ HO→ HO 2+ H 2 O reaction in the troposphere: competition between the one-step and stepwise mechanisms T Zhang, M Wen, Z Zeng, Y Lu, Y Wang, W Wang, X Shao, Z Wang, ... RSC advances 10 (15), 9093-9102, 2020 | 4 | 2020 |
Theoretical studies on the mechanism and kinetic for CH3CH2O + HO2 and CH3CHOH + HO2 reactions T Zhang, M Wen, Y Ju, J Kang, R Wang, J Cao, SK Roy Journal of Physical Organic Chemistry 32 (2), e3895, 2019 | 4 | 2019 |
Determining the mechanical and decomposition properties of high energetic materials (α-RDX, β-HMX, and ε-CL-20) using a neural network potential M Wen, X Chang, Y Xu, D Chen, Q Chu Physical Chemistry Chemical Physics 26 (13), 9984-9997, 2024 | 3 | 2024 |
Effect of ammonia, ammonia‐water, and sulfuric acid on the HO2 + HO2 → H2O2 + 3O2 reaction in troposphere: Competition between stepwise and one … M Wen, X Cao, Y Zhang, M Liang, T Zhang, B Muthiah, K Zhou, SK Roy, ... International Journal of Quantum Chemistry 120 (23), e26389, 2020 | 3 | 2020 |
The thermal decomposition mechanism of RDX/AP composites: ab initio neural network MD simulations K Pang, M Wen, X Chang, Y Xu, Q Chu, D Chen Physical Chemistry Chemical Physics 26 (15), 11545-11557, 2024 | 2 | 2024 |
Catalytic effect of (H 2 O) n (n= 1–3) clusters on the HO 2+ SO 2→ HOSO+ 3 O 2 reaction under tropospheric conditions R Wang, Q Yao, M Wen, S Tian, Y Wang, Z Wang, X Yu, X Shao, L Chen RSC advances 9 (28), 16195-16207, 2019 | 2 | 2019 |
Molecular mechanisms and atmospheric implications of the simplest criegee intermediate and hydrochloric acid chemistry in the gas phase and at the aqueous interfaces C Ding, M Wen, T Zhang, Z Li, R Li, R Wang, T Ou, F Song, Q Zhang Atmospheric Environment 330, 120558, 2024 | 1 | 2024 |
Influence of H2O and NH3 on the reaction of HO2 with NO in troposphere: Theoretical investigation of HNO3 formation pathways R Wang, Y Zhang, A Li, M Wen, Z Geng, X Geng, Z Wang, Z Wang, M Lily International Journal of Quantum Chemistry 121 (2), e26432, 2021 | 1 | 2021 |
Can (H2O)n (n = 1–2) as effective catalysts in the CH2OO + H2S reaction under tropospheric conditions? R Wang, M Wen, X Chen, Y Zhang, X Geng, Y Su, M Liang, X Shao, ... Molecular Physics 118 (18), e1753840, 2020 | 1 | 2020 |