First-principles study of native defects in bulk Sm2CuO4 and its (001) surface structure

Fubao Zheng; Qinfang Zhang; Qiangqiang Meng; Baolin Wang; Fengqi Song; Seiji Yunoki; Guanghou Wang

doi:10.1063/1.4989482

First-principles study of native defects in bulk Sm2CuO4 and its (001) surface structure

Journal of Applied Physics ◽

10.1063/1.4989482 ◽

2018 ◽

Vol 123 (16) ◽

pp. 161504 ◽

Cited By ~ 1

Author(s):

Fubao Zheng ◽

Qinfang Zhang ◽

Qiangqiang Meng ◽

Baolin Wang ◽

Fengqi Song ◽

...

Keyword(s):

Surface Structure ◽

First Principles ◽

Native Defects ◽

First Principles Study

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First-principles study of the morphology and surface structure of LaCoO3 and La0.5Sr0.5Fe0.5Co0.5O3 perovskites as air electrodes for solid oxide fuel cells

Science and Technology of Advanced Materials: Methods ◽

10.1080/27660400.2021.1909871 ◽

2021 ◽

Vol 1 (1) ◽

pp. 24-33

Author(s):

Masanobu Nakayama ◽

Katsuya Nishii ◽

Kentaro Watanabe ◽

Naoto Tanibata ◽

Hayami Takeda ◽

...

Keyword(s):

Fuel Cells ◽

Solid Oxide Fuel Cells ◽

Surface Structure ◽

First Principles ◽

Solid Oxide ◽

Oxide Fuel ◽

First Principles Study

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First-principles Study on Low Index Surface Structure Optimization and Surface Energy of LiMn2O4 Spinel Oxides

Acta Chimica Sinica ◽

10.6023/a21050213 ◽

2021 ◽

Vol 79 (8) ◽

pp. 1058

Author(s):

Yuan Lu ◽

Jifen Wang ◽

Huaqing Xie

Keyword(s):

Surface Energy ◽

Surface Structure ◽

First Principles ◽

Structure Optimization ◽

Limn2o4 Spinel ◽

First Principles Study ◽

Spinel Oxides

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Surface structure and doping-induced etching of Si(100) by chlorine: First-principles study

Physical Review B ◽

10.1103/physrevb.54.2210 ◽

1996 ◽

Vol 54 (3) ◽

pp. 2210-2216 ◽

Cited By ~ 5

Author(s):

Koichi Kato

Keyword(s):

Surface Structure ◽

First Principles ◽

First Principles Study

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First-principles study of native defects and lanthanum impurities inNaTaO3

Physical Review B ◽

10.1103/physrevb.78.014115 ◽

2008 ◽

Vol 78 (1) ◽

Cited By ~ 47

Author(s):

Minseok Choi ◽

Fumiyasu Oba ◽

Isao Tanaka

Keyword(s):

First Principles ◽

Native Defects ◽

First Principles Study

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First principles study on surface structure and stability of alloyed cementite doped with Cr

Materials Letters ◽

10.1016/j.matlet.2013.02.095 ◽

2013 ◽

Vol 100 ◽

pp. 170-172 ◽

Cited By ~ 18

Author(s):

Yang Gao ◽

Zhiqing Lv ◽

Shuhua Sun ◽

Minggui Qu ◽

Zhongping Shi ◽

...

Keyword(s):

Surface Structure ◽

First Principles ◽

Structure And Stability ◽

First Principles Study ◽

Alloyed Cementite

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First-principles study of native defects in rutile TiO2

Physics Letters A ◽

10.1016/j.physleta.2007.10.011 ◽

2008 ◽

Vol 372 (9) ◽

pp. 1527-1530 ◽

Cited By ~ 44

Author(s):

Haowei Peng

Keyword(s):

First Principles ◽

Rutile Tio2 ◽

Native Defects ◽

First Principles Study

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Surface structure effect on the magnetic anisotropy of Co/Pd (001) thin film: A first principles study

Thin Solid Films ◽

10.1016/j.tsf.2015.05.045 ◽

2015 ◽

Vol 589 ◽

pp. 252-257 ◽

Cited By ~ 2

Author(s):

Minyeong Je ◽

Heechae Choi ◽

Yubin Hwang ◽

Kyung-Han Yun ◽

Yong-Chae Chung

Keyword(s):

Thin Film ◽

Magnetic Anisotropy ◽

Surface Structure ◽

First Principles ◽

Structure Effect ◽

First Principles Study

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Magnetic interactions between native defects in ZnO: A first-principles study

Journal of the Korean Physical Society ◽

10.3938/jkps.63.2170 ◽

2013 ◽

Vol 63 (11) ◽

pp. 2170-2174 ◽

Cited By ~ 1

Author(s):

Eun-Cheol Lee

Keyword(s):

First Principles ◽

Magnetic Interactions ◽

Native Defects ◽

First Principles Study

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First-principles study of native defects in anataseTiO2

Physical Review B ◽

10.1103/physrevb.73.125205 ◽

2006 ◽

Vol 73 (12) ◽

Cited By ~ 276

Author(s):

Sutassana Na-Phattalung ◽

M. F. Smith ◽

Kwiseon Kim ◽

Mao-Hua Du ◽

Su-Huai Wei ◽

...

Keyword(s):

First Principles ◽

Native Defects ◽

First Principles Study

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The effect of surface structure on Ag atom adsorption over CuO(111) surfaces: A first principles study

Applied Surface Science ◽

10.1016/j.apsusc.2017.07.141 ◽

2017 ◽

Vol 425 ◽

pp. 1111-1117 ◽

Cited By ~ 7

Author(s):

Riming Hu ◽

Xiaolong Zhou ◽

Jie Yu

Keyword(s):

Surface Structure ◽

First Principles ◽

First Principles Study ◽

Effect Of Surface

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