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Theoretical Study of Hydrogen on LaFeO(3) (010) Surface Adsorption and Subsurface Diffusion

Based on density functional theory, this paper studies the adsorption and the subsurface occupation by H on LaFeO(3) (010) surface and their corresponding transition states. As shown from the results, the best storage positions of hydrogen are on the O top position of the LaFeO(3) (010) surface and...

पूर्ण विवरण

में बचाया:
ग्रंथसूची विवरण
में प्रकाशित:Materials (Basel)
मुख्य लेखकों: Pan, Changchang, Chen, Yuhong, Zhang, Meiling, Yuan, Lihua, Zhang, Cairong
स्वरूप: Artigo
भाषा:Inglês
प्रकाशित: MDPI 2018
विषय:
ऑनलाइन पहुंच:https://ncbi.nlm.nih.gov/pmc/articles/PMC6316970/
https://ncbi.nlm.nih.gov/pubmed/30469483
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ma11122347
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