𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Dehydrogenation kinetics of magnesium hydride investigated by DFT and experiment

✍ Scribed by Guangxin Wu; Jieyu Zhang; Qian Li; Yongquan Wu; Kuochih Chou; Xinhua Bao

Book ID
116375634
Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
479 KB
Volume
49
Category
Article
ISSN
0927-0256

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Density Functional Investigations of Ele
Density Functional Investigations of Electronic Structure and Dehydrogenation Reactions of Al- and Si-Substituted Magnesium Hydride
✍ Tuhina Kelkar; Sourav Pal; Dilip G. Kanhere πŸ“‚ Article πŸ“… 2008 πŸ› John Wiley and Sons 🌐 English βš– 374 KB

## Abstract The effect on the hydrogen storage attributes of magnesium hydride (MgH~2~) of the substitution of Mg by varying fractions of Al and Si is investigated by an ab initio plane‐wave pseuodopotential method based on density functional theory. Three supercells, namely, 2Γ—2Γ—2, 3Γ—1Γ—1 and 5Γ—1Γ—1

An investigation on the thermodynamics a
An investigation on the thermodynamics and kinetics of magnesium hydride decomposition based on isotope effects
✍ F. Leardini; J.R. Ares; J.F. FernΓ‘ndez; J. Bodega; C. SΓ‘nchez πŸ“‚ Article πŸ“… 2011 πŸ› Elsevier Science 🌐 English βš– 374 KB

This work investigates the thermodynamics and kinetics of magnesium hydride decomposition by analyzing isotope effects in hydride and deuteride samples. Complete pressure composition desorption isotherm measurements of MgD 2 are reported for the first time. Deuterium desorption enthalpy and entropy