Electronic, optical, phonon properties, elastic, and the hydrogen storage density of CsXBr3 (X: Be, Mg, Ca) perovskites: Ab-initio calculations and molecular dynamic (MD) simulation-Reference-Cited by-同舟云学术

Electronic, optical, phonon properties, elastic, and the hydrogen storage density of CsXBr3 (X: Be, Mg, Ca) perovskites: Ab-initio calculations and molecular dynamic (MD) simulation

Published:2023-12 Issue: Volume:183 Page:111636
ISSN:0022-3697
Container-title:Journal of Physics and Chemistry of Solids
language:en
Short-container-title:Journal of Physics and Chemistry of Solids

Author:

Ikot Immaculata J.,Louis Hitler^ORCID,Chukwu Udochukwu G.,Ashishie Providence B.,Magu Thomas O.,Agwamba Ernest C.^ORCID,Adeyinka Adedapo S.

Publisher

Elsevier BV

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

Reference58 articles.

1. Hydrogen fuel and fuel cell technology for cleaner future: a review;Singla;Environ. Sci. Pollut. Control Ser.,2021

2. Efficient esterification over hierarchical Zr-Beta zeolite synthesized via liquid-state ion-exchange strategy;Li;Fuel,2023

3. Hydrogen storage capacity of Al, Ca, Mg, Ni, and Zn decorated phosphorus-doped graphene: insight from theoretical calculations;Ikot;Int. J. Hydrogen Energy,2023

4. A review on the current progress of metal hydrides material for solid-state hydrogen storage applications;Rusman;Int. J. Hydrogen Energy,2016

5. Electronic structure and optical constants of CsPbCl3: the effect of approaches within ab initio calculations in relation to X-ray spectroscopy experiments;Vu;Mater. Chem. Phys.,2021

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