scholarly journals Electronic structures and optical properties of realistic transition metal dichalcogenide heterostructures from first principles

2013 ◽  
Vol 88 (8) ◽  
Author(s):  
Hannu-Pekka Komsa ◽  
Arkady V. Krasheninnikov
Keyword(s):  
Optical Properties ◽  
Transition Metal ◽  
First Principles ◽  
Electronic Structures ◽  
Transition Metal Dichalcogenide

scholarly journals The role of Anderson’s rule in determining electronic, optical and transport properties of transition metal dichalcogenide heterostructures

2018 ◽  
Vol 20 (48) ◽  
pp. 30351-30364 ◽  
Author(s):  
Ke Xu ◽  
Yuanfeng Xu ◽  
Hao Zhang ◽  
Bo Peng ◽  
Hezhu Shao ◽  
...  
Keyword(s):  
Optical Properties ◽  
Transition Metal ◽  
Transport Properties ◽  
First Principles ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenide ◽  
First Principles Calculations

We have investigated the structure and electronic, mechanical, transport and optical properties of van der Waals transition metal dichalcogenide heterostructures using first-principles calculations.

Electronic structures and optical properties of TM (Cr, Mn, Fe or Co) atom doped ZnSe nanosheets

RSC Advances ◽  
2015 ◽  
Vol 5 (128) ◽  
pp. 106227-106233 ◽  
Author(s):  
Xin-Lian Chen ◽  
Bao-Jun Huang ◽  
Yong Feng ◽  
Pei-Ji Wang ◽  
Chang-Wen Zhang ◽  
...  
Keyword(s):  
Optical Properties ◽  
Transition Metal ◽  
First Principles ◽  
Electronic Structures ◽  
First Principles Calculations

The electronic structures and optical properties of pristine and transition-metal (TM) atom doped ZnSe nanosheets (ZnSeNSs) have been studied based on first-principles calculations.

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