scholarly journals First-principle study of hydrogenation on monolayer MoS2

AIP Advances ◽  
2016 ◽  
Vol 6 (7) ◽  
pp. 075001 ◽  
Author(s):  
Yong Xu ◽  
Yin Li ◽  
Xi Chen ◽  
Chunfang Zhang ◽  
Ru Zhang ◽  
...  
Keyword(s):  
First Principle ◽  
Monolayer Mos2

Adsorption of NO and NO2 on monolayer MoS2: First principle study

2015 ◽  
pp. 745-748
Author(s):  
H Luo ◽  
Y Cao ◽  
J Feng ◽  
L Lan ◽  
N Zhang
Keyword(s):  
First Principle ◽  
Monolayer Mos2

Electronic structures and magnetic properties of S vacancy and Mn doped monolayer MoS2: A first-principle study

2019 ◽  
Vol 301 ◽  
pp. 113702 ◽  
Author(s):  
Long Lin ◽  
Jingtao Huang ◽  
Weiyang Yu ◽  
Linghao Zhu ◽  
Hualong Tao ◽  
...  
Keyword(s):  
Magnetic Properties ◽  
Electronic Structures ◽  
First Principle ◽  
Monolayer Mos2 ◽  
Mn Doped

Tunable redox potential of nonmetal doped monolayer MoS2: First principle calculations

2016 ◽  
Vol 384 ◽  
pp. 360-367 ◽  
Author(s):  
S. Lu ◽  
C. Li ◽  
Y.F. Zhao ◽  
Y.Y. Gong ◽  
L.Y. Niu ◽  
...  
Keyword(s):  
Redox Potential ◽  
First Principle ◽  
Monolayer Mos2 ◽  
First Principle Calculations

Analytical Monolayer MoS2 MOSFET Modeling Verified by First Principle Simulations

2020 ◽  
Vol 41 (1) ◽  
pp. 171-174 ◽  
Author(s):  
Zubair Ahmed ◽  
Qing Shi ◽  
Zichao Ma ◽  
Lining Zhang ◽  
Hong Guo ◽  
...  
Keyword(s):  
First Principle ◽  
Monolayer Mos2

scholarly journals The structural, electronic and catalytic properties of Aun (n = 1–4) nanoclusters on monolayer MoS2

RSC Advances ◽  
2017 ◽  
Vol 7 (67) ◽  
pp. 42529-42540 ◽  
Author(s):  
Hui Zhang ◽  
Jia Zhu ◽  
Hongge Zhang ◽  
Jinyan Zhang ◽  
Yongfan Zhang ◽  
...  
Keyword(s):  
Structural Stability ◽  
Dft Calculation ◽  
Catalytic Properties ◽  
Van Der Waals ◽  
First Principle ◽  
Monolayer Mos2

The structural stability, electronic and catalytic properties of Aun (n = 1–4) nanoclusters supported on monolayer MoS2 have been investigated based on first principle DFT calculation with van der Waals (vdW) corrections.

Study of interfacial strain at the α-Al2O3/monolayer MoS2 interface by first principle calculations

2018 ◽  
Vol 428 ◽  
pp. 593-597 ◽  
Author(s):  
Sheng Yu ◽  
Shunjie Ran ◽  
Hao Zhu ◽  
Kwesi Eshun ◽  
Chen Shi ◽  
...  
Keyword(s):  
First Principle ◽  
Monolayer Mos2 ◽  
First Principle Calculations ◽  
Interfacial Strain ◽  
Α Al2o3

Evolution of local strain in Ag-deposited monolayer MoS2 modulated by interface interactions

Nanoscale ◽  
2019 ◽  
Vol 11 (46) ◽  
pp. 22432-22439 ◽  
Author(s):  
Yinghui Sun ◽  
Yan Aung Moe ◽  
Yingying Xu ◽  
Yufei Sun ◽  
Xuewen Wang ◽  
...  
Keyword(s):  
Local Strain ◽  
Monolayer Mos2 ◽  
Interface Interaction

Local strain is best preserved on Al2O3 but relaxed most easily on mica because of the interface interaction from substrates.

Sign in / Sign up

Export Citation Format

Share Document