Light metal functionalized two-dimensional siligene for high capacity hydrogen storage: DFT study

2020 ◽  
Author(s):  
Akari Narayama Sosa ◽  
Brandom Jhoseph Cid ◽  
Álvaro Miranda ◽  
Luis Antonio Pérez ◽  
Fernando Salazar ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Light Metal ◽  
Dft Study ◽  
Two Dimensional

Ultra-high capacity hydrogen storage in a Li decorated two-dimensional C2N layer

2017 ◽  
Vol 5 (6) ◽  
pp. 2821-2828 ◽  
Author(s):  
Arqum Hashmi ◽  
M. Umar Farooq ◽  
Imran Khan ◽  
Jicheol Son ◽  
Jisang Hong
Keyword(s):  
Hydrogen Storage ◽  
2D Materials ◽  
High Capacity ◽  
Two Dimensional ◽  
Adsorption Energies

Gravimetric density vs. adsorption energies of existing 2D materials and adsorbed H2 molecules as a function of pressure and temperature on Li doped C2N.

C7N6 monolayer as high capacity and reversible hydrogen storage media: A DFT study

2021 ◽  
Author(s):  
Song Hu ◽  
Yongliang Yong ◽  
Zijia Zhao ◽  
Ruilin Gao ◽  
Qingxiao Zhou ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Dft Study ◽  
Storage Media

High capacity and reversible hydrogen storage on two dimensional C 2 N monolayer membrane

2018 ◽  
Vol 43 (21) ◽  
pp. 9895-9901 ◽  
Author(s):  
Gangqiang Qin ◽  
Qianyi Cui ◽  
Baofeng Yun ◽  
Lixiang Sun ◽  
Aijun Du ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
High Capacity ◽  
Two Dimensional

Elucidating hydrogen storage properties of two-dimensional siligraphene (SiC8) monolayers upon selected metal decoration

2020 ◽  
Vol 4 (11) ◽  
pp. 5578-5587
Author(s):  
Ekaterina Anikina ◽  
Tanveer Hussain ◽  
Valery Beskachko ◽  
Rajeev Ahuja
Keyword(s):  
Thermodynamic Properties ◽  
Hydrogen Storage ◽  
Light Metal ◽  
Two Dimensional ◽  
Hydrogen Storage Properties ◽  
Metal Decoration ◽  
Storage Properties ◽  
The U.S

DFT investigation of hydrogen (H2) adsorption on pristine and light metal decorated siligraphene SiC8 showed that Ca@SiC8 and Li@SiC8 have promising thermodynamic properties and H2 uptake, which surpasses the U.S. Department of Energy's 2025 goal.

Reinforcing the tetracene-based two-dimensional C48H16 sheet by decorating the Li, Na, and K atoms for hydrogen storage and environmental application –A DFT study

2022 ◽  
Vol 204 ◽  
pp. 112114
Author(s):  
Mohanapriya Subramani ◽  
Akilan Rajamani ◽  
Vijayakumar Subramaniam ◽  
Mohammad Rafe Hatshan ◽  
Sivalingam Gopi ◽  
...  
Keyword(s):  
Hydrogen Storage ◽  
Dft Study ◽  
Two Dimensional ◽  
Environmental Application
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