Pressure-induced structural stability of alkali trihydrides and H<inf>2</inf>-desorption occurrence: Ab initio study for hydrogen storage improvement

• Main Authors: Prayoonsak Pluengphon, Prutthipong Tsuppayakorn-aek, Burapat Inceesungvorn, Thiti Bovornratanaraks
• Format: Journal
• Published: 2020
• Subjects: Energy; Physics and Astronomy
• Online Access: https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=85088214646&origin=inward; http://cmuir.cmu.ac.th/jspui/handle/6653943832/70512
• Institution: Chiang Mai University

© 2020 Hydrogen Energy Publications LLC Alkali trihydrides in the forms of LiH(H2) and NaH(H2) have attracted considerable attention due to its containing of the high-gravimetric hydrogen capacity. Structural and mechanical stabilities, thermodynamic and electronic properties, and H-vacancy occurren...