TY - JOUR
T1 - Buckled graphene: A model study based on density functional theory
AU - Khan, Yasser
AU - Mukaddam, Mohsin Ahmed
AU - Schwingenschlögl, Udo
N1 - KAUST Repository Item: Exported on 2020-10-01
PY - 2010/9
Y1 - 2010/9
N2 - We make use of ab initio calculations within density functional theory to investigate the influence of buckling on the electronic structure of single layer graphene. Our systematic study addresses a wide range of bond length and bond angle variations in order to obtain insights into the energy scale associated with the formation of ripples in a graphene sheet. © 2010 Elsevier B.V. All rights reserved.
AB - We make use of ab initio calculations within density functional theory to investigate the influence of buckling on the electronic structure of single layer graphene. Our systematic study addresses a wide range of bond length and bond angle variations in order to obtain insights into the energy scale associated with the formation of ripples in a graphene sheet. © 2010 Elsevier B.V. All rights reserved.
UR - http://hdl.handle.net/10754/561531
UR - https://linkinghub.elsevier.com/retrieve/pii/S0009261410011632
UR - http://www.scopus.com/inward/record.url?scp=77957016382&partnerID=8YFLogxK
U2 - 10.1016/j.cplett.2010.08.059
DO - 10.1016/j.cplett.2010.08.059
M3 - Article
SN - 0009-2614
VL - 498
SP - 157
EP - 161
JO - Chemical Physics Letters
JF - Chemical Physics Letters
IS - 1-3
ER -