scholarly journals Molecule-Adsorbed Topological Insulator and Metal Surfaces: A Comparative First-Principles Study

2018 ◽  
Vol 30 (6) ◽  
pp. 1849-1855 ◽  
Author(s):  
Soumyajit Sarkar ◽  
Jing Yang ◽  
Liang Z. Tan ◽  
Andrew M. Rappe ◽  
Leeor Kronik
Keyword(s):  
Topological Insulator ◽  
First Principles ◽  
Metal Surfaces ◽  
First Principles Study

Thermoelectric properties of topological insulator lanthanum phosphide via first-principles study

2019 ◽  
Vol 125 (4) ◽  
pp. 045107 ◽  
Author(s):  
Yu Zhou ◽  
Wang-Li Tao ◽  
Zhao-Yi Zeng ◽  
Xiang-Rong Chen ◽  
Qi-Feng Chen
Keyword(s):  
Thermoelectric Properties ◽  
Topological Insulator ◽  
First Principles ◽  
First Principles Study

Water adsorption at metal surfaces: A first-principles study of thep(3×3)R30°H2Obilayer on Ru(0001)

2005 ◽  
Vol 71 (15) ◽  
Author(s):  
Giuliana Materzanini ◽  
Gian Franco Tantardini ◽  
Philip J. D. Lindan ◽  
Peter Saalfrank
Keyword(s):  
First Principles ◽  
Metal Surfaces ◽  
Water Adsorption ◽  
First Principles Study

scholarly journals Strain induced quantum spin Hall insulator in monolayer β-BiSb from first-principles study

RSC Advances ◽  
2017 ◽  
Vol 7 (44) ◽  
pp. 27816-27822 ◽  
Author(s):  
Weiyang Yu ◽  
Chun-Yao Niu ◽  
Zhili Zhu ◽  
Xiaolin Cai ◽  
Liwei Zhang ◽  
...  
Keyword(s):  
Transport Properties ◽  
Quantum Transport ◽  
Topological Insulator ◽  
First Principles ◽  
Electronic Devices ◽  
Quantum Spin ◽  
Lower Power ◽  
First Principles Study ◽  
Potential Applications ◽  
Quantum Spin Hall

Topological insulator (TI) is a peculiar phase of matter exhibiting excellent quantum transport properties with potential applications in lower-power-consuming electronic devices.

Magnetic doping of4dtransition-metal surfaces: A first-principles study

2005 ◽  
Vol 71 (9) ◽  
Author(s):  
S. Dennler ◽  
J. Hafner ◽  
M. Marsman ◽  
J. Morillo
Keyword(s):  
First Principles ◽  
Metal Surfaces ◽  
First Principles Study ◽  
Magnetic Doping

First-principles study of benzene on noble metal surfaces: Adsorption states and vacuum level shifts

2009 ◽  
Vol 603 (18) ◽  
pp. 2912-2922 ◽  
Author(s):  
Kenji Toyoda ◽  
Yosuke Nakano ◽  
Ikutaro Hamada ◽  
Kyuho Lee ◽  
Susumu Yanagisawa ◽  
...  
Keyword(s):  
Noble Metal ◽  
First Principles ◽  
Metal Surfaces ◽  
Vacuum Level ◽  
First Principles Study ◽  
Level Shifts

First-principles study of electronic, magnetic and optical properties of N doping topological insulator Bi2Se3

2019 ◽  
Vol 132 ◽  
pp. 106161 ◽  
Author(s):  
Dan Wang ◽  
Min Zhang ◽  
Ligang Liu ◽  
Xinyou An ◽  
Xiaoyang Ma ◽  
...  
Keyword(s):  
Optical Properties ◽  
Topological Insulator ◽  
First Principles ◽  
First Principles Study ◽  
N Doping
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