Adsorption Behaviors of Different Water Structures on the Fluorapatite (001) Surface: A DFT Study-Reference-Cited by-同舟云学术

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Adsorption Behaviors of Different Water Structures on the Fluorapatite (001) Surface: A DFT Study

Published:2020-03-12 Issue: Volume:7 Page:
ISSN:2296-8016
Container-title:Frontiers in Materials
language:
Short-container-title:Front. Mater.

Author:

Cui Weiyong,Song Xueli,Chen Jianhua,Chen Ye,Li Yuqiong,Zhao Cuihua

Funder

National Natural Science Foundation of China

Natural Science Foundation of Guangxi Province

Publisher

Frontiers Media SA

Subject

Materials Science (miscellaneous)

Reference28 articles.

1. Probing the surface structure of hydroxyapatite using NMR spectroscopy and first principles calculations.;Chappell;Phys. Chem. Chem. Phys.,2008

2. DFT study of coadsorption of water and oxygen on galena (PbS) surface: an insight into the oxidation mechanism of galena.;Chen;Appl. Surf. Sci.,2017

3. First principles methods using CASTEP.;Clark;Z. Krist.,2005

4. Structural and vibrational behaviour of– uorapatite with pressure. Part I: in situ single-crystal X-ray diffraction investigation.;Comodi;Phys. Chem. Miner.,2001

5. First-principles study of the (001) surface of cubic BiAlO3.;Cui;Phys. B Condens. Matter.,2010

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