High-pressure phases induce H-vacancy diffusion kinetics in TM-doped MgH<inf>2</inf>: Ab initio study for hydrogen storage improvement

© 2019 Hydrogen Energy Publications LLC The improvement of the hydrogen storage mechanism in TM-doped MgH2 by structural high-pressure effects has been found using ab initio calculation. Phase transition, formation enthalpy and H-vacancy mechanism of α-, β-, and γ-MgH2 with 3.125% of Ni, Pd and Pd d...

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Bibliographic Details
Main Authors: Prayoonsak Pluengphon, T. Bovornratanaraks, Prutthipong Tsuppayakorn-aek, Udomsilp Pinsook, Burapat Inceesungvorn
Format: Journal
Published: 2019
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Online Access:https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85068206905&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/65585
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Institution: Chiang Mai University
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