Mechanism and Active Species in NH3 Dehydrogenation under an Electrochemical Environment: An Ab Initio Molecular Dynamics Study
Mechanism and Active Species in NH3 Dehydrogenation under an Electrochemical Environment: An Ab Initio Molecular Dynamics Study
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电化学环境下 NH3 脱氢的机理和活性物质:从头算分子动力学研究
DOI:
10.1021/acscatal.0c05247
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发表时间:
2021-03
期刊:
影响因子:
12.9
通讯作者:
Bo Yang
中科院分区:
文献类型:
--
作者:
Kunran Yang;Jian Liu;Bo Yang
The electrochemical ammonia oxidation reaction (AOR) has attracted considerable attention in the past decades. However, the AOR mechanism on the electrode surface is still ambiguous, and the identi...
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影响因子:
3.7
作者:
Kresse, G;Furthmuller, J
通讯作者:
Furthmuller, J
影响因子:
5.7
作者:
Chan, Karen;Norskov, Jens K.
通讯作者:
Norskov, Jens K.
影响因子:
5.7
作者:
Chant, Karen;Norskov, Jens K.
通讯作者:
Norskov, Jens K.
影响因子:
3.3
作者:
Climent, Victor;Gomez, Roberto;Feliu, Juan M.
通讯作者:
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影响因子:
4.5
作者:
GERISCHER, H;MAUERER, A
通讯作者:
MAUERER, A