Reversible hydrogen storage on alkali metal (Li and Na) decorated C20 fullerene: A density functional study
出版年份 2021 全文链接
标题
Reversible hydrogen storage on alkali metal (Li and Na) decorated C20 fullerene: A density functional study
作者
关键词
DFT, Hydrogen storage, C20 fullerene, van't Hoff equation, ADMP
出版物
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
Volume 46, Issue 80, Pages 40251-40261
出版商
Elsevier BV
发表日期
2021-10-19
DOI
10.1016/j.ijhydene.2021.09.219
参考文献
相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。- Hydrogen storage capacity of low-lying isomer of C24 functionalized with Ti
- (2020) Rohit Y. Sathe et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Effect of the N/P/S and transition-metal co-doping on the quantum capacitance of supercapacitor electrodes based on mono- and multilayer graphene
- (2020) Qingxiao Zhou et al. CARBON
- Hydrogen storage in scandium doped small boron clusters (BnSc2, n=3–10): A density functional study
- (2019) Shakti S. Ray et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Mg@C60 nano-lamellae and its 12.50 wt% hydrogen storage capacity
- (2019) Ying Wang et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Novel hierarchical sea urchin-like Prussian blue@palladium core–shell heterostructures supported on nitrogen-doped reduced graphene oxide: Facile synthesis and excellent guanine sensing performance
- (2019) Junhua Li et al. ELECTROCHIMICA ACTA
- Stable structures of exohedrally decorated C 60 -fullerenes
- (2018) Deb Sankar De et al. CARBON
- Hydrogen storage property of alkali and alkaline-earth metal atoms decorated C 24 fullerene: A DFT study
- (2018) Yafei Zhang et al. CHEMICAL PHYSICS
- Enhanced Hydrogen-Storage Capacity and Structural Stability of an Organic Clathrate Structure with Fullerene (C60) Guests and Lithium Doping
- (2018) Yesol Woo et al. CHEMISTRY OF MATERIALS
- Structural, electrical and optical properties of Li n @C 20 ( n = 1–6) nanoclusters
- (2018) Zohreh Khajehali et al. COMPTES RENDUS CHIMIE
- Boron substitution effect on adsorption of H 2 molecules on organometallic complexes
- (2018) Priyanka Tavhare et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- The interaction of hydrogen with Li-coated C 70 fullerene: A DFT study
- (2018) Maryam Anafcheh et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Decoration of doped C 60 fullerene with alkali metals: Prototype nanomaterial with enhanced binding energy toward hydrogen
- (2017) Akbar Omidvar et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- On enhanced hydrogen adsorption on alkali (cesium) doped C 60 and effects of the quantum nature of the H 2 molecule on physisorption energies
- (2017) Alexander Kaiser et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- A DFT study of the hydrogen storage potentials and properties of Na- and Li-doped fullerenes
- (2017) HongJiang Ren et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Investigation of graphene-based systems for hydrogen storage
- (2017) Hamid Ghorbani Shiraz et al. RENEWABLE & SUSTAINABLE ENERGY REVIEWS
- Hydrogen Storage Technologies for Future Energy Systems
- (2017) Patrick Preuster et al. Annual Review of Chemical and Biomolecular Engineering
- Molecular hydrogen storage in fullerenes – A dispersion-corrected density functional theory study
- (2016) D.J. Durbin et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Hydrogenation mechanism of small fullerene cages
- (2016) A.A. EL-Barbary INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Hydrogen Desorption Kinetics in Metal Intercalated Fullerides
- (2015) Philippe Mauron et al. Journal of Physical Chemistry C
- DFT study of hydrogen storage in Pd-decorated C60fullerene
- (2015) A. M. El Mahdy MOLECULAR PHYSICS
- Designs of fullerene-based frameworks for hydrogen storage
- (2014) Yi Gao et al. Journal of Materials Chemistry A
- Hydrogen Storage in Yttrium-Decorated Single Walled Carbon Nanotube
- (2012) Brahmananda Chakraborty et al. Journal of Physical Chemistry C
- High-capacity hydrogen storage medium: Ti doped fullerene
- (2011) Jun Guo et al. APPLIED PHYSICS LETTERS
- Effect of the damping function in dispersion corrected density functional theory
- (2011) Stefan Grimme et al. JOURNAL OF COMPUTATIONAL CHEMISTRY
- A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
- (2010) Stefan Grimme et al. JOURNAL OF CHEMICAL PHYSICS
- Functionalized heterofullerenes for hydrogen storage
- (2009) Qiang Sun et al. APPLIED PHYSICS LETTERS
- Storage of hydrogen in nanostructured carbon materials
- (2009) Yuda Yürüm et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- Hydrogen storage capacity of C60(OM)12 (M=Li and Na) clusters
- (2009) Qi Peng et al. JOURNAL OF CHEMICAL PHYSICS
- Calcium-decorated carbon nanotubes for high-capacity hydrogen storage: First-principles calculations
- (2009) Hoonkyung Lee et al. PHYSICAL REVIEW B
- Why Li Doping in MOFs Enhances H2 Storage Capacity? A Multi-scale Theoretical Study
- (2008) A. Mavrandonakis et al. Journal of Physical Chemistry C
- Structure, Stability, Edge States, and Aromaticity of Graphene Ribbons
- (2008) Tobias Wassmann et al. PHYSICAL REVIEW LETTERS
- Titanium-functional group complexes for high-capacity hydrogen storage materials
- (2008) Hoonkyung Lee et al. SOLID STATE COMMUNICATIONS
- Alkali-Metal-Induced Enhancement of Hydrogen Adsorption in C60Fullerene: Anab InitioStudy
- (2007) K. R. S. Chandrakumar et al. NANO LETTERS
Add your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload NowAsk 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