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Article: Influence of titanium on the hydrogen storage characteristics of magnesium hydride: A first principles investigation

TitleInfluence of titanium on the hydrogen storage characteristics of magnesium hydride: A first principles investigation
Authors
Song, Y.Guo, Z. X.Yang, R.
KeywordsMagnesium hydride
First principles
Hydrogen storage
Issue Date2004
Citation
Materials Science and Engineering A, 2004, v. 365, n. 1-2, p. 73-79 How to Cite?
DOI: http://dx.doi.org/10.1016/j.msea.2003.09.008
AbstractFirst principles calculations of MgH2and MgH2-Ti were presented to investigate the influence of titanium on the properties of hydrogen sorption of magnesium hydrides. The heat of formation of MgH2-Ti was enhanced compared with that of MgH2. The bonding between magnesium and hydrogen was weakened, while a stronger interaction between titanium and hydrogen exists if titanium is in solution of the magnesium hydride. © 2003 Elsevier B.V. All rights reserved.
Persistent Identifierhttp://hdl.handle.net/10722/262894
ISSN
0921-5093
2023 Impact Factor: 6.1
2023 SCImago Journal Rankings: 1.660
ISI Accession Number ID
WOS:000187972000010

 

DC FieldValueLanguage
dc.contributor.authorSong, Y.-
dc.contributor.authorGuo, Z. X.-
dc.contributor.authorYang, R.-
dc.date.accessioned2018-10-08T09:28:44Z-
dc.date.available2018-10-08T09:28:44Z-
dc.date.issued2004-
dc.identifier.citationMaterials Science and Engineering A, 2004, v. 365, n. 1-2, p. 73-79-
dc.identifier.issn0921-5093-
dc.identifier.urihttp://hdl.handle.net/10722/262894-
dc.description.abstractFirst principles calculations of MgH2and MgH2-Ti were presented to investigate the influence of titanium on the properties of hydrogen sorption of magnesium hydrides. The heat of formation of MgH2-Ti was enhanced compared with that of MgH2. The bonding between magnesium and hydrogen was weakened, while a stronger interaction between titanium and hydrogen exists if titanium is in solution of the magnesium hydride. © 2003 Elsevier B.V. All rights reserved.-
dc.languageeng-
dc.relation.ispartofMaterials Science and Engineering A-
dc.subjectMagnesium hydride-
dc.subjectFirst principles-
dc.subjectHydrogen storage-
dc.titleInfluence of titanium on the hydrogen storage characteristics of magnesium hydride: A first principles investigation-
dc.typeArticle-
dc.description.naturelink_to_subscribed_fulltext-
dc.identifier.doi10.1016/j.msea.2003.09.008-
dc.identifier.scopuseid_2-s2.0-0346886912-
dc.identifier.volume365-
dc.identifier.issue1-2-
dc.identifier.spage73-
dc.identifier.epage79-
dc.identifier.isiWOS:000187972000010-
dc.identifier.issnl0921-5093-

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