Density functional theory calculation of monolayer WTe2 transition metal dichalcogenides doped with H, Li and Be
| dc.contributor.author | Igumbor, Emmanuel | |
| dc.contributor.author | Mapasha, Refilwe Edwin | |
| dc.contributor.author | Meyer, Walter Ernst | |
| dc.date.accessioned | 2018-05-08T11:18:25Z | |
| dc.date.issued | 2018-04 | |
| dc.description.abstract | Please read abstract in the article. | en_ZA |
| dc.description.department | Physics | en_ZA |
| dc.description.embargo | 2019-04-15 | |
| dc.description.librarian | hj2018 | en_ZA |
| dc.description.sponsorship | The National Research Foundation of South Africa (Grant No. 98961). | en_ZA |
| dc.description.uri | http://www.elsevier.com/locate/physb | en_ZA |
| dc.identifier.citation | Igumbor, E., Mapasha, R.E. & Meyer, W.E. 2018, 'Density functional theory calculation of monolayer WTe2 transition metal dichalcogenides doped with H, Li and Be', Physica B: Condensed Matter, vol. 535, pp. 167-170. | en_ZA |
| dc.identifier.issn | 1873-2135 (online) | |
| dc.identifier.issn | 0921-4526 (print) | |
| dc.identifier.other | 10.1016/j.physb.2017.07.024 | |
| dc.identifier.uri | http://hdl.handle.net/2263/64787 | |
| dc.language.iso | en | en_ZA |
| dc.publisher | Elsevier | en_ZA |
| dc.rights | © 2017 Published by Elsevier B.V. Notice : this is the author’s version of a work that was accepted for publication in Physica B: Consensed Matter. Changes resulting from the publishing process, such as peer review, editing, corrections, structural formatting, and other quality control mechanisms may not be reflected in this document. A definitive version was subsequently published in Physica B: Consensed Matter, vol. 535, pp. 167-170, 2018. doi : 10.1016/j.physb.2017.07.024. | en_ZA |
| dc.subject | Total energy calculations | en_ZA |
| dc.subject | Structural properties | en_ZA |
| dc.subject | Electronic properties | en_ZA |
| dc.subject | Density functional theory (DFT) | en_ZA |
| dc.subject | Formation energy | en_ZA |
| dc.subject | Dopant | en_ZA |
| dc.subject | Electronic structure | en_ZA |
| dc.title | Density functional theory calculation of monolayer WTe2 transition metal dichalcogenides doped with H, Li and Be | en_ZA |
| dc.type | Postprint Article | en_ZA |