Journal Article10.1016/j.fuel.2024.132474
Theoretical screening of single transition-metal atoms anchored Janus MoSSe monolayers as efficient electrocatalysts for nitrogen fixation
Jia-Xing Guo,Shao-Yi Wu,Chunyu Yao,Rong-Gang Tian,Shunping Shi +4 more
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About: This article is published in Fuel. The article was published on 01 Oct 2024. The article focuses on the topics: Janus & Transition metal.
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Citations
Tailoring the electrocatalytic activity of B-doped Nb2CT2 (T = O, S, Se, Te) MXenes for nitrogen reduction: a DFT study on the synergistic effects of surface termination and strain
Xiao Qian (林曉倩) Lin,Zhen-Hong Han,Xin Zhang,Jin-Xia Yang,Yuan‐Gen Yao +4 more
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A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
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