Theoretical insight into the wavelength-dependent photodissociation mechanism of nitric acid-Reference-Cited by-同舟云学术

Theoretical insight into the wavelength-dependent photodissociation mechanism of nitric acid

Author:

Xiao Hongyan¹²³⁴⁵,Maeda Satoshi⁶⁷⁸⁹¹⁰,Morokuma Keiji¹¹¹²¹³¹⁰¹⁴

Affiliation:

1. Key Laboratory of Photochemical Conversion and Optoelectronic Materials

2. Technical Institute of Physics and Chemistry

3. Chinese Academy of Sciences

4. Beijing 100190

5. People's Republic of China

6. Department of Chemistry

7. Faculty of Science

8. Hokkaido University

9. Sapporo 060-0810

10. Japan

11. Fukui Institute for Fundamental Chemistry

12. Kyoto University

13. Kyoto 606-8103

14. Cherry L. Emerson Center for Scientific Computation and Department of Chemistry

Abstract

The MS-CASPT2 method is used to study O(¹D) + HONO and OH + NO₂ photodissociation pathways of HNO₃ in the four lowest electronic singlet states.

Funder

Core Research for Evolutional Science and Technology, Japan Science and Technology Agency

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

Reference46 articles.

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