Characteristics of boron and nitrogen species on aluminum surface
The interactions of boron and nitrogen atoms with an aluminum (0 0 1) surface have been studied by means of density functional theory (DFT). Calculations of potential energy surfaces show that the nitrogen adsorption favors the formation of stronger bond with aluminum than the boron adsorption. This...
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| Veröffentlicht in: | Computational materials science 2002-04, Vol.23 (1), p.38-42 |
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| container_title | Computational materials science |
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| creator | Zhang, R.Q Lo, S.F Wan, J Yu, D.K Lee, S.T |
| description | The interactions of boron and nitrogen atoms with an aluminum (0
0
1) surface have been studied by means of density functional theory (DFT). Calculations of potential energy surfaces show that the nitrogen adsorption favors the formation of stronger bond with aluminum than the boron adsorption. This study indicates that a surface substrate of nitride as the first step in boron nitride deposition on aluminum would facilitate a good adhesion of the grown film with the substrate. |
| doi_str_mv | 10.1016/S0927-0256(01)00207-5 |
| format | Article |
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0
1) surface have been studied by means of density functional theory (DFT). Calculations of potential energy surfaces show that the nitrogen adsorption favors the formation of stronger bond with aluminum than the boron adsorption. This study indicates that a surface substrate of nitride as the first step in boron nitride deposition on aluminum would facilitate a good adhesion of the grown film with the substrate.</description><identifier>ISSN: 0927-0256</identifier><identifier>EISSN: 1879-0801</identifier><identifier>DOI: 10.1016/S0927-0256(01)00207-5</identifier><language>eng</language><publisher>Amsterdam: Elsevier B.V</publisher><subject>Adhesion ; Aluminum surface ; Boron nitride ; Condensed matter: electronic structure, electrical, magnetic, and optical properties ; Density functional theory (DFT) ; Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures ; Exact sciences and technology ; Impurity and defect levels; energy states of adsorbed species ; Physics ; Surface and interface electron states</subject><ispartof>Computational materials science, 2002-04, Vol.23 (1), p.38-42</ispartof><rights>2002 Elsevier Science B.V.</rights><rights>2002 INIST-CNRS</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c368t-6eea9d4860f0bcddb628d31398107645a074882f1dc3bf8b9e9ca5718bda88ce3</citedby><cites>FETCH-LOGICAL-c368t-6eea9d4860f0bcddb628d31398107645a074882f1dc3bf8b9e9ca5718bda88ce3</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><linktohtml>$$Uhttps://www.sciencedirect.com/science/article/pii/S0927025601002075$$EHTML$$P50$$Gelsevier$$H</linktohtml><link.rule.ids>309,310,314,776,780,785,786,3537,23909,23910,25118,27901,27902,65306</link.rule.ids><backlink>$$Uhttp://pascal-francis.inist.fr/vibad/index.php?action=getRecordDetail&idt=13657732$$DView record in Pascal Francis$$Hfree_for_read</backlink></links><search><creatorcontrib>Zhang, R.Q</creatorcontrib><creatorcontrib>Lo, S.F</creatorcontrib><creatorcontrib>Wan, J</creatorcontrib><creatorcontrib>Yu, D.K</creatorcontrib><creatorcontrib>Lee, S.T</creatorcontrib><title>Characteristics of boron and nitrogen species on aluminum surface</title><title>Computational materials science</title><description>The interactions of boron and nitrogen atoms with an aluminum (0
0
1) surface have been studied by means of density functional theory (DFT). Calculations of potential energy surfaces show that the nitrogen adsorption favors the formation of stronger bond with aluminum than the boron adsorption. This study indicates that a surface substrate of nitride as the first step in boron nitride deposition on aluminum would facilitate a good adhesion of the grown film with the substrate.</description><subject>Adhesion</subject><subject>Aluminum surface</subject><subject>Boron nitride</subject><subject>Condensed matter: electronic structure, electrical, magnetic, and optical properties</subject><subject>Density functional theory (DFT)</subject><subject>Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures</subject><subject>Exact sciences and technology</subject><subject>Impurity and defect levels; energy states of adsorbed species</subject><subject>Physics</subject><subject>Surface and interface electron states</subject><issn>0927-0256</issn><issn>1879-0801</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2002</creationdate><recordtype>article</recordtype><recordid>eNqFkE1LxDAQhoMouK7-BKEXRQ_VSdrm4yTL4hcseFDPIU2mGumma9IK_nu7H-jR08DM884wDyGnFK4oUH79DIqJHFjFL4BeAjAQebVHJlQKlYMEuk8mv8ghOUrpA8ackmxCZvN3E43tMfrUe5uyrsnqLnYhM8Flwfexe8OQpRVaj-N07LfD0odhmaUhNsbiMTloTJvwZFen5PXu9mX-kC-e7h_ns0VuCy77nCMa5UrJoYHaOldzJl1BCyUpCF5WBkQpJWuos0XdyFqhsqYSVNbOSGmxmJLz7d5V7D4HTL1e-mSxbU3AbkiacQ5SlmoEqy1oY5dSxEavol-a-K0p6LUwvRGm1zY0UL0Rpqsxd7Y7YJI1bRNNsD79hQteCVGwkbvZcjh---Ux6jS6CRadj2h77Tr_z6UfEqJ_tA</recordid><startdate>20020401</startdate><enddate>20020401</enddate><creator>Zhang, R.Q</creator><creator>Lo, S.F</creator><creator>Wan, J</creator><creator>Yu, D.K</creator><creator>Lee, S.T</creator><general>Elsevier B.V</general><general>Elsevier Science</general><scope>IQODW</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7QF</scope><scope>8BQ</scope><scope>8FD</scope><scope>JG9</scope></search><sort><creationdate>20020401</creationdate><title>Characteristics of boron and nitrogen species on aluminum surface</title><author>Zhang, R.Q ; Lo, S.F ; Wan, J ; Yu, D.K ; Lee, S.T</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c368t-6eea9d4860f0bcddb628d31398107645a074882f1dc3bf8b9e9ca5718bda88ce3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2002</creationdate><topic>Adhesion</topic><topic>Aluminum surface</topic><topic>Boron nitride</topic><topic>Condensed matter: electronic structure, electrical, magnetic, and optical properties</topic><topic>Density functional theory (DFT)</topic><topic>Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures</topic><topic>Exact sciences and technology</topic><topic>Impurity and defect levels; energy states of adsorbed species</topic><topic>Physics</topic><topic>Surface and interface electron states</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Zhang, R.Q</creatorcontrib><creatorcontrib>Lo, S.F</creatorcontrib><creatorcontrib>Wan, J</creatorcontrib><creatorcontrib>Yu, D.K</creatorcontrib><creatorcontrib>Lee, S.T</creatorcontrib><collection>Pascal-Francis</collection><collection>CrossRef</collection><collection>Aluminium Industry Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Materials Research Database</collection><jtitle>Computational materials science</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Zhang, R.Q</au><au>Lo, S.F</au><au>Wan, J</au><au>Yu, D.K</au><au>Lee, S.T</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Characteristics of boron and nitrogen species on aluminum surface</atitle><jtitle>Computational materials science</jtitle><date>2002-04-01</date><risdate>2002</risdate><volume>23</volume><issue>1</issue><spage>38</spage><epage>42</epage><pages>38-42</pages><issn>0927-0256</issn><eissn>1879-0801</eissn><abstract>The interactions of boron and nitrogen atoms with an aluminum (0
0
1) surface have been studied by means of density functional theory (DFT). Calculations of potential energy surfaces show that the nitrogen adsorption favors the formation of stronger bond with aluminum than the boron adsorption. This study indicates that a surface substrate of nitride as the first step in boron nitride deposition on aluminum would facilitate a good adhesion of the grown film with the substrate.</abstract><cop>Amsterdam</cop><pub>Elsevier B.V</pub><doi>10.1016/S0927-0256(01)00207-5</doi><tpages>5</tpages></addata></record> |
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| ispartof | Computational materials science, 2002-04, Vol.23 (1), p.38-42 |
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| language | eng |
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| source | Elsevier ScienceDirect Journals Complete |
| subjects | Adhesion Aluminum surface Boron nitride Condensed matter: electronic structure, electrical, magnetic, and optical properties Density functional theory (DFT) Electronic structure and electrical properties of surfaces, interfaces, thin films and low-dimensional structures Exact sciences and technology Impurity and defect levels energy states of adsorbed species Physics Surface and interface electron states |
| title | Characteristics of boron and nitrogen species on aluminum surface |
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