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Buckled graphene: A model study based on density functional theory

✍ Scribed by M.A. Khan; M.A. Mukaddam; U. Schwingenschlögl

Book ID
108109238
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
948 KB
Volume
498
Category
Article
ISSN
0009-2614

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The influence of potassium (K) on the hydrogen (H) adsorption on graphene (G) was studied by means of density functional theory with the generalized gradient approximation. The structural parameters, bonding and magnetic properties of one and two H atoms interacting with potassium doped graphene (H–