Tunable H 2 binding on alkaline and alkaline earth metals decorated graphene substrates from first-principles calculations

Title
Tunable H 2 binding on alkaline and alkaline earth metals decorated graphene substrates from first-principles calculations
Authors
Keywords
Metals decorated graphene substrates, H, 2, adsorption energy, Dipole–dipole interaction, Charge transfer, Multiple H, 2, adsorption
Journal
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
Volume 42, Issue 15, Pages 10064-10071
Publisher
Elsevier BV
Online
2017-02-24
DOI
10.1016/j.ijhydene.2017.02.023

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