Interface Effects Induced by a ZrO2 Seed Layer on the Phase Stability and Orientation of HfO2 Ferroelectric Thin Films: A First-Principles Study

Physical Review Applied ◽

10.1103/physrevapplied.16.044048 ◽

2021 ◽

Vol 16 (4) ◽

Author(s):

Can Huang ◽

Yuke Zhang ◽

Shuaizhi Zheng ◽

Qiong Yang ◽

Min Liao

Keyword(s):

Phase Stability ◽

First Principles ◽

Ferroelectric Thin Films ◽

First Principles Study ◽

Interface Effects

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First-principles study of two-dimensional electron and hole gases at the head-to-head and tail-to-tail 180∘ domain walls in PbTiO3 ferroelectric thin films

Physical Review B ◽

10.1103/physrevb.101.174114 ◽

2020 ◽

Vol 101 (17) ◽

Author(s):

James Sifuna ◽

Pablo García-Fernández ◽

George S. Manyali ◽

George Amolo ◽

Javier Junquera

Keyword(s):

First Principles ◽

Domain Walls ◽

Ferroelectric Thin Films ◽

Two Dimensional ◽

Dimensional Electron ◽

First Principles Study

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First-principles study of ultrafast and nonlinear optical properties of graphite thin films

Physical Review B ◽

10.1103/physrevb.103.085433 ◽

2021 ◽

Vol 103 (8) ◽

Author(s):

Mitsuharu Uemoto ◽

Shintaro Kurata ◽

Norihito Kawaguchi ◽

Kazuhiro Yabana

Keyword(s):

Optical Properties ◽

First Principles ◽

Nonlinear Optical ◽

Nonlinear Optical Properties ◽

First Principles Study

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Impacts of atomic and magnetic configurations on the phase stability of Fe–Pd shape memory alloys: A first-principles study

Journal of Applied Physics ◽

10.1063/5.0029951 ◽

2021 ◽

Vol 129 (3) ◽

pp. 035105

Author(s):

Chun-Mei Li ◽

Shun-Jie Yang ◽

Yang Zhang ◽

Ren-Zhong Huang

Keyword(s):

Shape Memory Alloys ◽

Shape Memory ◽

Phase Stability ◽

First Principles ◽

First Principles Study

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Tailoring the anomalous Hall effect of SrRuO3 thin films by strain: A first principles study

Journal of Applied Physics ◽

10.1063/5.0043742 ◽

2021 ◽

Vol 129 (9) ◽

pp. 093904

Author(s):

Kartik Samanta ◽

Marjana Ležaić ◽

Stefan Blügel ◽

Yuriy Mokrousov

Keyword(s):

Hall Effect ◽

First Principles ◽

Anomalous Hall Effect ◽

First Principles Study

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Effect of Hf additions on phase stability and mechanical properties of binary W-Hf alloys: A first-principles study

Fusion Engineering and Design ◽

10.1016/j.fusengdes.2018.10.007 ◽

2018 ◽

Vol 137 ◽

pp. 295-302 ◽

Author(s):

Diyou Jiang ◽

Tao Wang ◽

Xiaohua Huang ◽

Xiongzhi Zou ◽

Jianfeng Hu

Keyword(s):

Mechanical Properties ◽

Phase Stability ◽

First Principles ◽

First Principles Study

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New interface effects in ferroelectric thin films

Journal de Physique IV (Proceedings) ◽

10.1051/jp4:20011102 ◽

2001 ◽

Vol 11 (PR11) ◽

pp. Pr11-9-Pr11-19 ◽

Author(s):

J. F. Scott ◽

M. Dawber

Keyword(s):

Ferroelectric Thin Films ◽

Interface Effects

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First-principles study of the phase stability and elastic properties of Ti-X alloys (X = Mo, Nb, Al, Sn, Zr, Fe, Co, and O)

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2017.08.128 ◽

2017 ◽

Vol 727 ◽

pp. 579-595 ◽

Author(s):

Wenchong Zhou ◽

Ryoji Sahara ◽

Koichi Tsuchiya

Keyword(s):

Elastic Properties ◽

Phase Stability ◽

First Principles ◽

First Principles Study

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First-principles study of phase stability and elastic properties in metastable Ti-Mo alloys with cluster structure

Molecular Simulation ◽

10.1080/08927022.2018.1526377 ◽

2018 ◽

Vol 45 (1) ◽

pp. 26-34 ◽

Author(s):

Mingjia Li ◽

Xiaohua Min ◽

Fei Ye ◽

Ping Li ◽

Congqian Cheng ◽

...

Keyword(s):

Elastic Properties ◽

Phase Stability ◽

First Principles ◽

Cluster Structure ◽

First Principles Study

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Pressure dependent phase stability transformations of GaS: A first principles study

Materials Science in Semiconductor Processing ◽

10.1016/j.mssp.2010.12.001 ◽

2010 ◽

Vol 13 (4) ◽

pp. 295-297 ◽

Author(s):

Bin Wen ◽

Roderick Melnik ◽

Shan Yao ◽

Tingju Li

Keyword(s):

Phase Stability ◽

First Principles ◽

First Principles Study

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A first-principles study of phase stability in Ni–Al and Ni–Ti alloys

High Temperature Aluminides and Intermetallics ◽

10.1016/b978-1-85166-822-9.50005-4 ◽

1992 ◽

pp. 1-8 ◽

Author(s):

M. Sluiter ◽

P.E.A. Turchi ◽

F.J. Pinski ◽

G.M. Stocks

Keyword(s):

Phase Stability ◽

First Principles ◽

First Principles Study ◽

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