A DFT study of dopant (Zr, Nb) and vacancies on the dehydrogenation on MgH2 (001) surface-Reference-Cited by-同舟云学术

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A DFT study of dopant (Zr, Nb) and vacancies on the dehydrogenation on MgH2 (001) surface

Published:2014-01 Issue:4 Volume:39 Page:1732-1739
ISSN:0360-3199
Container-title:International Journal of Hydrogen Energy
language:en
Short-container-title:International Journal of Hydrogen Energy

Author:

Germán Estefanía,Luna Carla,Marchetti Jorge,Jasen Paula,Macchi Carlos,Juan Alfredo

Funder

SGCyT (UNS)

IFISUR-CONICET

CIFICEN (CIC-UNICEN-CONICET)

PICT 1770

CIC Provincia de Buenos Aires

Publisher

Elsevier BV

Subject

Energy Engineering and Power Technology,Condensed Matter Physics,Fuel Technology,Renewable Energy, Sustainability and the Environment

Reference52 articles.

1. Hydrogen-storage materials for mobile applications;Schlapbach;Nature,2001

2. Recent advances in hydride chemistry;Perruzini,2001

3. Metal hydride materials for solid hydrogen storage: a review;Sakintuna;Int J Hydrogen Energy,2007

4. Catalytic effect of Ni nanoparticles on the desorption kinetics of MgH2 nanoparticles;Xie;J Alloy Compd,2009

5. Mechanical alloying and electronic simulations of (MgH2 + M) systems (M = Al, Ti, Fe, Ni, Cu and Nb) for hydrogen storage;Shang;Int J Hydrogen Energy,2004

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1. The impact of vacancy defective MgH2 (001)/(110) surface on the dehydrogenation of MgH2@Ni-CNTs: A mechanistic investigation;Journal of Materials Science & Technology;2024-08

2. Behavior of Hydrogen Absorption and Desorption in Y-doped Ti Films;ACTA METALL SIN;2024

3. Construction of Mg/Zr superlattice structure to achieve efficient hydrogen storage via atomic-scale interaction in Mg-Zr modulation films;Acta Materialia;2024-01

4. Exploring the Hydrogen Storage Performance of MgH₂ Catalyzed by Two Transition Metals Ni and Co by In‐situ Calorimetry and Density Functional Theory Calculations;ChemistrySelect;2023-12-10

5. Determining the Effect of Cation (Ti/Zr) Doping in Bismuth Oxide for Electrochemical CO₂ Reduction to Formic Acid: A DFT Study;Energy & Fuels;2023-08-21

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