Catalytic effect of (H2O)n (n = 1–3) clusters on the HO2 + SO2 → HOSO + 3O2 reaction under tropospheric conditions-Reference-Cited by-同舟云学术

Catalytic effect of (H2O)n (n = 1–3) clusters on the HO2 + SO2 → HOSO + 3O2 reaction under tropospheric conditions

Published:2019 Issue:28 Volume:9 Page:16195-16207
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Wang Rui¹²³⁴⁵^ORCID,Yao Qiuyue⁶⁷⁸⁹¹⁰,Wen Mingjie¹²³⁴⁵,Tian Shaobo¹²³⁴⁵,Wang Yan¹²³⁴⁵,Wang Zhiyin¹²³⁴⁵,Yu Xiaohu¹²³⁴⁵^ORCID,Shao Xianzhao¹²³⁴⁵,Chen Long¹¹¹²¹³¹⁴⁵

Affiliation:

1. Shaanxi Key Laboratory of Catalysis

2. School of Chemical & Environment Science

3. Shaanxi University of Technology

4. Hanzhong

5. P. R. China

6. Henan Key Laboratory of Boron Chemistry and Advanced Energy Materials

7. School of Chemistry and Chemical Engineering

8. Henan Normal University

9. Xinxiang

10. China

11. Key Lab of Aerosol Chemistry & Physics

12. Institute of Earth Environment

13. Chinese Academy of Sciences

14. Xi'an

Abstract

The HO₂ + SO₂ → HOSO + ³O₂ reaction without and with (H₂O)n (n = 1–3) have been investigated using CCSD(T)/CBS//M06-2X/aug-cc-pVTZ methods, and canonical variational transition state theory with small curvature tunneling.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2019/RA/C9RA00169G

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