Morphology and surface properties of LiVOPO4: a first principles study

Yuhan Li; Jingping Zhang; Fengmei Yang; Jing Liang; Hao Sun; Shuwei Tang; Rongshun Wang

doi:10.1039/c4cp03628j

Morphology and surface properties of LiVOPO4: a first principles study

Physical Chemistry Chemical Physics ◽

10.1039/c4cp03628j ◽

2014 ◽

Vol 16 (44) ◽

pp. 24604-24609 ◽

Cited By ~ 12

Author(s):

Yuhan Li ◽

Jingping Zhang ◽

Fengmei Yang ◽

Jing Liang ◽

Hao Sun ◽

...

Keyword(s):

Surface Properties ◽

First Principles ◽

First Principles Study

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First-principles study of the surface properties of U-Mo system

Computational Materials Science ◽

10.1016/j.commatsci.2017.10.033 ◽

2018 ◽

Vol 142 ◽

pp. 355-360 ◽

Cited By ~ 8

Author(s):

Zhi-Gang Mei ◽

Linyun Liang ◽

Abdellatif M. Yacout

Keyword(s):

Surface Properties ◽

First Principles ◽

First Principles Study

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First-principles study of crystal-face specificity in surface properties of Fe-rich Fe-Cr alloys

Physical Review Materials ◽

10.1103/physrevmaterials.3.034401 ◽

2019 ◽

Vol 3 (3) ◽

Author(s):

Xiaojie Li ◽

Stephan Schönecker ◽

Xiaoqing Li ◽

Shengzhi Hao ◽

Jijun Zhao ◽

...

Keyword(s):

Surface Properties ◽

First Principles ◽

Crystal Face ◽

First Principles Study

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First-principles study of the surface properties of uranium carbides

Journal of Nuclear Materials ◽

10.1016/j.jnucmat.2020.152257 ◽

2020 ◽

Vol 542 ◽

pp. 152257

Author(s):

Zhi-Gang Mei ◽

Bei Ye ◽

Abdellatif M. Yacout ◽

Benjamin Beeler ◽

Yipeng Gao

Keyword(s):

Surface Properties ◽

First Principles ◽

First Principles Study

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First-principles study of the surface properties of γ-LiAlO2: Stability and tritium adsorption

Journal of Nuclear Materials ◽

10.1016/j.jnucmat.2019.05.007 ◽

2019 ◽

Vol 522 ◽

pp. 1-10 ◽

Cited By ~ 4

Author(s):

Ting Jia ◽

Zhi Zeng ◽

Hari Paudel ◽

David J. Senor ◽

Yuhua Duan

Keyword(s):

Surface Properties ◽

First Principles ◽

First Principles Study

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Towards tuning of surface properties by atomic and molecular adsorption on boron-terminated cubic boron nitride (111) surface: A first-principles study

Diamond and Related Materials ◽

10.1016/j.diamond.2008.07.003 ◽

2008 ◽

Vol 17 (12) ◽

pp. 2048-2053 ◽

Cited By ~ 6

Author(s):

Man-Fai Ng ◽

Mui Kheng Teo ◽

Kok Hwa Lim ◽

Liping Zhou ◽

Michael B. Sullivan ◽

...

Keyword(s):

Boron Nitride ◽

Surface Properties ◽

First Principles ◽

Cubic Boron Nitride ◽

Molecular Adsorption ◽

First Principles Study

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First-principles study of surface properties ofLiFePO4: Surface energy, structure, Wulff shape, and surface redox potential

Physical Review B ◽

10.1103/physrevb.76.165435 ◽

2007 ◽

Vol 76 (16) ◽

Cited By ~ 187

Author(s):

L. Wang ◽

F. Zhou ◽

Y. S. Meng ◽

G. Ceder

Keyword(s):

Surface Energy ◽

Redox Potential ◽

Surface Properties ◽

First Principles ◽

Energy Structure ◽

Wulff Shape ◽

First Principles Study ◽

Surface Redox

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A first-principles study of PuN (0 0 1) surface properties

Journal of Nuclear Materials ◽

10.1016/j.jnucmat.2015.03.046 ◽

2015 ◽

Vol 462 ◽

pp. 114-118

Author(s):

G. Li ◽

X.C. Lv

Keyword(s):

Surface Properties ◽

First Principles ◽

First Principles Study

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First-principles study of surface properties of PuO2: Effects of thickness and O-vacancy on surface stability and chemical activity

Journal of Nuclear Materials ◽

10.1016/j.jnucmat.2012.02.029 ◽

2012 ◽

Vol 426 (1-3) ◽

pp. 139-147 ◽

Cited By ~ 32

Author(s):

Bo Sun ◽

Haifeng Liu ◽

Haifeng Song ◽

Guangcai Zhang ◽

Hui Zheng ◽

...

Keyword(s):

Surface Properties ◽

First Principles ◽

Chemical Activity ◽

Surface Stability ◽

First Principles Study ◽

O Vacancy

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Generalized-stacking-fault energy and surface properties for HCP metals: A first-principles study

Applied Surface Science ◽

10.1016/j.apsusc.2009.12.042 ◽

2010 ◽

Vol 256 (11) ◽

pp. 3409-3412 ◽

Cited By ~ 64

Author(s):

Xiaozhi Wu ◽

Rui Wang ◽

Shaofeng Wang

Keyword(s):

Surface Properties ◽

First Principles ◽

Stacking Fault ◽

Stacking Fault Energy ◽

First Principles Study ◽

Generalized Stacking Fault ◽

Generalized Stacking Fault Energy

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Impact of strain on the surface properties of transition metal carbide films: First-principles study

Journal of Applied Physics ◽

10.1063/1.3327423 ◽

2010 ◽

Vol 107 (8) ◽

pp. 083521 ◽

Cited By ~ 17

Author(s):

D. I. Bazhanov ◽

I. V. Mutigullin ◽

A. A. Knizhnik ◽

B. V. Potapkin ◽

A. A. Bagaturyants ◽

...

Keyword(s):

Transition Metal ◽

Surface Properties ◽

First Principles ◽

Transition Metal Carbide ◽

Metal Carbide ◽

First Principles Study

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