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Adsorption and Decomposition of Sarin on Dry and Wet Cu2O(111) and CuO(111) Surfaces: Insight from First-Principles Calculations

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Year: 2021
Type: article
Source: The Journal of Physical Chemistry C
DOI: 10.1021/acs.jpcc.1c07072
Authors: Denghui Ma, Zexing Cao
Institution: Xiamen University
Language: English

Topic: Copper-based nanomaterials and applications
Subfield: Materials Chemistry
Field: Materials Science
Domain: Physical Sciences

Open Access status: closed

Funder: National Natural Science Foundation of China
Awards: 碳基小分子催化定向转化及外场与表界面效应的多尺度全程模拟研究, 呋喃类生物燃料热解自由基激发态及其与分子氧反应过程的理论研究, 酶催化二氧化碳捕获与还原转化的量子-经典力学研究
OpenAlex ID: W3209155482
FWCI: 0.853
Cites: 72
Cited by: 17
Related to: 10
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