The hydrogen storage capacity of Sc atoms decorated porous boron fullerene B40: a DFT study

C Tang, X Zhang - International Journal of Hydrogen Energy, 2016 - Elsevier
The hydrogen storage capacity of transition metal Sc atoms decorated porous boron
fullerene B 40 is investigated by the pseudopotential density functional method. The B 40 …

DFT simulation on hydrogen storage property over Sc decorated B38 fullerene

P Liu, F Liu, Q Wang, Q Ma - International Journal of Hydrogen Energy, 2018 - Elsevier
In this study, the structural stability and hydrogen adsorption of Sc@ B 38 are investigated
using density functional theory (DFT). Sc atoms are found to be sufficiently bonded to the B …

Transition metal Ti coated porous fullerene C24B24: potential material for hydrogen storage

C Tang, S Chen, W Zhu, J Kang, X He… - International Journal of …, 2015 - Elsevier
The hydrogen storage capacity of transition metal Ti atoms decorated porous fullerene C 24
B 24 is investigated by the pseudopotential density functional method. The C 24 B 24 cage …

On enhanced hydrogen adsorption on alkali (cesium) doped C60 and effects of the quantum nature of the H2 molecule on physisorption energies

A Kaiser, M Renzler, L Kranabetter… - International Journal of …, 2017 - Elsevier
Hydrogen storage by physisorption in carbon based materials is hindered by low adsorption
energies. In the last decade doping of carbon materials with alkali, earth alkali or other metal …

Hydrogen Sorption in Li12C60

P Mauron, M Gaboardi, A Remhof… - The Journal of …, 2013 - ACS Publications
The lithium-intercalated fulleride Li12C60 was investigated in view of a lightweight hydrogen
storage material due to the low molecular weight of its constituents. Deuterium (D2) …

Reversible Hydrogen Storage in a LiBH4–C60 Nanocomposite

PA Ward, JA Teprovich Jr, B Peters… - The Journal of …, 2013 - ACS Publications
Reversible hydrogen storage in a LiBH4: C60 nanocomposite (70: 30 wt%) synthesized by
solvent-assisted mixing has been demonstrated. During the solvent-assisted mixing and …

Evaluation of the physi-and chemisorption of hydrogen in alkali (Na, Li) doped fullerenes

PA Ward, JA Teprovich Jr, RN Compton… - international journal of …, 2015 - Elsevier
In this study, alkali doped fullerenes synthesized by two different solvent assisted mixing
techniques are compared for their hydrogen uptake activity. In particular, we investigated the …

Experimental and Theoretical Analysis of Fast Lithium Ionic Conduction in a LiBH4–C60 Nanocomposite

JA Teprovich Jr, HR Colón-Mercado… - The Journal of …, 2014 - ACS Publications
We have developed a LiBH4–C60 nanocomposite that displays fast lithium ionic conduction
in the solid state. The material is a homogeneous nanocomposite that contains both LiBH4 …

Relaxation dynamics and phase transitions in ionic liquids: viscoelastic properties from the liquid to the solid state

O Palumbo, F Trequattrini, FM Vitucci… - The Journal of Physical …, 2015 - ACS Publications
In the present work we performed low-frequency mechanical spectroscopy experiments to
measure the mechanical modulus of two ionic liquids and its variation during the main …

Hydrogen desorption kinetics in metal intercalated fullerides

P Mauron, M Gaboardi, D Pontiroli… - The Journal of …, 2015 - ACS Publications
For different hydrogenated metal intercalated fullerides (Na10C60-H, Li12C60-H, and
Li28C60-H) the activation energies for hydrogen desorption were determined by DSC. The …