Interactions of water molecule with HfB2 and TaB2 (0001) surfaces: A first-principles investigation-Reference-Cited by-同舟云学术

Interactions of water molecule with HfB2 and TaB2 (0001) surfaces: A first-principles investigation

Published:2015-02 Issue: Volume:97 Page:116-120
ISSN:0927-0256
Container-title:Computational Materials Science
language:en
Short-container-title:Computational Materials Science

Author:

Liu Dongliang,Deng Jianguo,Jin Yongzhong

Funder

from Material Corrosion and Protection Key Laboratory of Sichuan Province

Publisher

Elsevier BV

Subject

Computational Mathematics,General Physics and Astronomy,Mechanics of Materials,General Materials Science,General Chemistry,General Computer Science

Reference28 articles.

1. FRL-PR-ED-TP-1998-007;Upadhya,1997

2. A model for the oxidation of ZrB2, HfB2 and TiB2

3. A Perspective on Modeling Materials in Extreme Environments: Oxidation of Ultrahigh-Temperature Ceramics

4. L. Kaufman, E.V. Clougherty, Investigation of boride compounds for very high temperature applications, ManLabs Inc, Cambridge, MA, Technical Documentary Report No. RTD-TDR-63-4096, Part II, 1965.

Cited by 8 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. First-principles calculations on adsorption-diffusion behavior of transition layer Ti atoms on the Fe surface;Journal of Vacuum Science & Technology A;2024-08-16

2. Role of Si in the Oxide Nucleation and Growth Mechanisms of 60Si2Mn Spring Steel: Experimental and First-Principles Study;Oxidation of Metals;2022-10-03

3. First principles molecular dynamics simulations of H2S dissociation on Fe (1 1 1) in aqueous environments;Applied Surface Science;2021-07

4. First-principles calculation of atomic structure, stability and electronic structure of TaB2/SiC interface;Modelling and Simulation in Materials Science and Engineering;2021-04-14

5. Insight into the structure stability and bonding nature of HfB2(0001)/SiC(111) interface: A first-principles study;Ceramics International;2021-02