First-principles study of the interaction of hydrogen molecular on Na-adsorbed graphene
Published 2014 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
First-principles study of the interaction of hydrogen molecular on Na-adsorbed graphene
Authors
Keywords
Atom-adsorbed graphene, Hydrogen storage, Renewable energy, Density functional theory (DFT)
Journal
Applied Nanoscience
Volume 5, Issue 4, Pages 393-402
Publisher
Springer Nature
Online
2014-07-22
DOI
10.1007/s13204-014-0329-y
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Band gap tunning in BN-doped graphene systems with high carrier mobility
- (2014) T. P. Kaloni et al. APPLIED PHYSICS LETTERS
- First-principles study of the stability of graphene and adsorption of halogen atoms (F, Cl and Br) on hydrogen passivated graphene
- (2014) D. B. Karki et al. INTERNATIONAL JOURNAL OF MODERN PHYSICS B
- Physical origins of weak H2 binding on carbon nanostructures: Insight from ab initio studies of chemically functionalized graphene nanoribbons
- (2014) Kanchan Ulman et al. JOURNAL OF CHEMICAL PHYSICS
- A first-principles investigation of the optical spectra of oxidized graphene
- (2013) N. Singh et al. APPLIED PHYSICS LETTERS
- Modelling magnetism of C at O and B monovacancies in graphene
- (2013) T.P. Kaloni et al. CARBON
- Substrate-enhanced superconductivity in Li-decorated graphene
- (2013) T. P. Kaloni et al. EPL
- Fluorinated monovacancies in graphene: Even-odd effect
- (2012) T. P. Kaloni et al. EPL
- K-intercalated carbon systems: Effects of dimensionality and substrate
- (2012) T. P. Kaloni et al. EPL
- Methane and carbon dioxide adsorption on edge-functionalized graphene: A comparative DFT study
- (2012) Brandon C. Wood et al. JOURNAL OF CHEMICAL PHYSICS
- Perspective: Advances and challenges in treating van der Waals dispersion forces in density functional theory
- (2012) Jiří Klimeš et al. JOURNAL OF CHEMICAL PHYSICS
- Electronic properties of boron- and nitrogen-doped graphene: a first principles study
- (2012) Sugata Mukherjee et al. JOURNAL OF NANOPARTICLE RESEARCH
- Electronic structures of graphane with vacancies and graphene adsorbed with fluorine atoms
- (2012) Bi-Ru Wu et al. AIP Advances
- Induced magnetism in transition metal intercalated graphitic systems
- (2011) T. P. Kaloni et al. JOURNAL OF MATERIALS CHEMISTRY
- Bonding and charge transfer by metal adatom adsorption on graphene
- (2011) Xiaojie Liu et al. PHYSICAL REVIEW B
- Engineering quantum anomalous/valley Hall states in graphene via metal-atom adsorption: Anab-initiostudy
- (2011) Jun Ding et al. PHYSICAL REVIEW B
- Strain effects on hydrogen storage capability of metal-decorated graphene: A first-principles study
- (2010) Miao Zhou et al. APPLIED PHYSICS LETTERS
- Graphene-based nanomaterials for energy storage
- (2010) Martin Pumera Energy & Environmental Science
- Hydrogen Adsorption on sp$^2$-Bonded Carbon Structures: Ab-initio Study
- (2010) Young-Kyun Kwon JOURNAL OF THE KOREAN PHYSICAL SOCIETY
- Tunable Excitons in Biased Bilayer Graphene
- (2010) Cheol-Hwan Park et al. NANO LETTERS
- Adsorption of monovalent metal atoms on graphene: a theoretical approach
- (2010) Paulo V C Medeiros et al. NANOTECHNOLOGY
- Atomic layers of hybridized boron nitride and graphene domains
- (2010) Lijie Ci et al. NATURE MATERIALS
- Palladium atoms and its dimers adsorbed on graphene: First-principles study
- (2010) R. Thapa et al. PHYSICA B-CONDENSED MATTER
- Missing Atom as a Source of Carbon Magnetism
- (2010) M. M. Ugeda et al. PHYSICAL REVIEW LETTERS
- Electronic property of Na-doped epitaxial graphenes on SiC
- (2009) Seon-Myeong Choi et al. APPLIED PHYSICS LETTERS
- Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
- (2009) Jiayu Dai et al. APPLIED PHYSICS LETTERS
- QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
- (2009) Paolo Giannozzi et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Mechanisms of molecular doping of graphene: A first-principles study
- (2009) Srijan Kumar Saha et al. PHYSICAL REVIEW B
- Density functional theory study of Fe, Co, and Ni adatoms and dimers adsorbed on graphene
- (2009) Harman Johll et al. PHYSICAL REVIEW B
- The electronic properties of graphene
- (2009) A. H. Castro Neto et al. REVIEWS OF MODERN PHYSICS
- Graphene: Status and Prospects
- (2009) A. K. Geim SCIENCE
- Prompted hydrogenation of carbon nanotubes by doping light metals
- (2008) Bei Chen et al. APPLIED PHYSICS LETTERS
- High-capacity hydrogen storage by metallized graphene
- (2008) C. Ataca et al. APPLIED PHYSICS LETTERS
- Functionalization of carbon-based nanostructures with light transition-metal atoms for hydrogen storage
- (2008) E. Durgun et al. PHYSICAL REVIEW B
- Vacancy-induced magnetism in graphene and graphene ribbons
- (2008) J. J. Palacios et al. PHYSICAL REVIEW B
- First-principles study of metal adatom adsorption on graphene
- (2008) Kevin T. Chan et al. PHYSICAL REVIEW B
- Metal-Organic Framework from an Anthracene Derivative Containing Nanoscopic Cages Exhibiting High Methane Uptake
- (2007) Shengqian Ma et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Alkali-Metal-Induced Enhancement of Hydrogen Adsorption in C60Fullerene: Anab InitioStudy
- (2007) K. R. S. Chandrakumar et al. NANO LETTERS
Find the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
SearchAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started