Ab initio investigation of Al/Mo2B interfacial adhesion
| dc.contributor.author | Si Abdelkader, H | en_US |
| dc.contributor.author | Faraoun, Hi | en_US |
| dc.date.accessioned | 2013-05-15T12:07:30Z | en_US |
| dc.date.available | 2013-05-15T12:07:30Z | en_US |
| dc.date.issued | 2011-01 | en_US |
| dc.description | Computational Materials Science, ISSN : 0927-0256, DOI : 10.1016/j.commatsci.2010.10.025, Issue : 3, Volume : 50, pp. 880–885, January 2011. | en_US |
| dc.description.abstract | First-principles calculations were performed to study the adhesion and the interfacial electronic structure of aluminum/molybdenum semi-boride (Al/Mo2B) interface. The work of adhesion (Wad) was calculated for both terminations of the Mo2B surface and it was found that Mo-terminated has larger Wad than the B-terminated one. It was shown that interfacial Al and B atoms form polar covalent bonds, while bonding of interfacial Al and Mo atoms mainly presents metallic character. | en_US |
| dc.identifier.issn | 0927-0256 | en_US |
| dc.identifier.uri | https://dspace.univ-tlemcen.dz/handle/112/1894 | en_US |
| dc.language.iso | en | en_US |
| dc.publisher | University of Tlemcen | en_US |
| dc.subject | Ab initio calculations | en_US |
| dc.subject | Adhesion | en_US |
| dc.subject | Surface and interface | en_US |
| dc.subject | Aluminum | en_US |
| dc.subject | Molybdenum borides | en_US |
| dc.title | Ab initio investigation of Al/Mo2B interfacial adhesion | en_US |
| dc.type | Article | en_US |