Functionalization and migration of bromine adatoms on zigzag graphene nanoribbons: A first-principles study

2018 ◽  
Author(s):  
Neeraj K. Jaiswal ◽  
Amit Kumar ◽  
Chandrabhan Patel
Keyword(s):  
First Principles ◽  
Graphene Nanoribbons ◽  
First Principles Study ◽  
And Migration ◽  
Zigzag Graphene Nanoribbons

scholarly journals Understanding the spin-dependent electronic properties of symmetrically far-edge doped zigzag graphene nanoribbon from a first principles study

RSC Advances ◽  
2017 ◽  
Vol 7 (74) ◽  
pp. 46604-46614 ◽  
Author(s):  
Amrit Sarmah ◽  
Pavel Hobza
Keyword(s):  
Electronic Properties ◽  
First Principles ◽  
Graphene Nanoribbons ◽  
Graphene Nanoribbon ◽  
First Principles Study ◽  
Dft Simulations ◽  
Zigzag Graphene Nanoribbons

DFT simulations envision that far-edge doping also induced some tunable spin-dependent properties in the zigzag graphene nanoribbons.

First-Principles Study of Cu Doped Zigzag Graphene Nanoribbons

2011 ◽  
Author(s):  
Neeraj K. Jaiswal ◽  
Pankaj Srivastava ◽  
Alka B. Garg ◽  
R. Mittal ◽  
R. Mukhopadhyay
Keyword(s):  
First Principles ◽  
Graphene Nanoribbons ◽  
First Principles Study ◽  
Zigzag Graphene Nanoribbons
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