Influence of Water on Anharmonicity, Stability, and Vibrational Energy Distribution of Hydrogen-Bonded Adducts in Atmospheric Reactions: Case Study of the OH + Isoprene Reaction Intermediate Using Ab Initio Molecular Dynamics-Reference-Cited by-同舟云学术

Influence of Water on Anharmonicity, Stability, and Vibrational Energy Distribution of Hydrogen-Bonded Adducts in Atmospheric Reactions: Case Study of the OH + Isoprene Reaction Intermediate Using Ab Initio Molecular Dynamics

Published:2011-12-27 Issue:1 Volume:116 Page:399-414
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Dietrick Scott M.¹,Pacheco Alexander B.¹,Phatak Prasad¹,Stevens Philip S.²,Iyengar Srinivasan S.³

Affiliation:

1. Department of Chemistry, Indiana University, Bloomington, Indiana 47405, United States

2. Department of Chemistry and Center for Research in Environmental Science, School of Public and Environmental Affairs, Indiana University, Bloomington, Indiana 47405, United States

3. Departments of Chemistry and Physics, Indiana University, Bloomington, Indiana 47405, United States

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp204511v

Reference100 articles.

1. Tropospheric Ozone: The Debate over Control Strategies

2. Measurement of OH and HO2 in the Troposphere

3. HOxbudgets in a deciduous forest: Results from the PROPHET summer 1998 campaign

4. OH and HO2 radical chemistry in a forested region of north-western Greece

5. Are plant emissions green?

Cited by 27 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Quantum Algorithms for the Study of Electronic Structure and Molecular Dynamics: Novel Computational Protocols;Comprehensive Computational Chemistry;2024

2. Graph-|Q⟩⟨C|: A Quantum Algorithm with Reduced Quantum Circuit Depth for Electronic Structure;The Journal of Physical Chemistry A;2023-10-31

3. Graph Theoretic Molecular Fragmentation for Multidimensional Potential Energy Surfaces Yield an Adaptive and General Transfer Machine Learning Protocol;Journal of Chemical Theory and Computation;2022-08-22

4. Graph-|Q⟩⟨C|, a Graph-Based Quantum/Classical Algorithm for Efficient Electronic Structure on Hybrid Quantum/Classical Hardware Systems: Improved Quantum Circuit Depth Performance;Journal of Chemical Theory and Computation;2022-04-12

5. Graph-Theory-Based Molecular Fragmentation for Efficient and Accurate Potential Surface Calculations in Multiple Dimensions;Journal of Chemical Theory and Computation;2021-10-08