Performance of 12 DFT Functionals in the Study of Crystal Systems: Al2SiO5 Orthosilicates and Al Hydroxides as a Case Study
| dc.contributor.author | Demichelis, Raffaella | |
| dc.contributor.author | Civalleri, B. | |
| dc.contributor.author | D'Arco, P. | |
| dc.contributor.author | Dovesi, R. | |
| dc.date.accessioned | 2017-01-30T12:03:58Z | |
| dc.date.available | 2017-01-30T12:03:58Z | |
| dc.date.created | 2014-10-08T03:10:54Z | |
| dc.date.issued | 2010 | |
| dc.identifier.citation | Demichelis, R. and Civalleri, B. and D'Arco, P. and Dovesi, R. 2010. Performance of 12 DFT Functionals in the Study of Crystal Systems: Al2SiO5 Orthosilicates and Al Hydroxides as a Case Study. International Journal of Quantum Chemistry. 110: pp. 2260-2273. | |
| dc.identifier.uri | http://hdl.handle.net/20.500.11937/17775 | |
| dc.publisher | John Wiley & Sons Inc | |
| dc.title | Performance of 12 DFT Functionals in the Study of Crystal Systems: Al2SiO5 Orthosilicates and Al Hydroxides as a Case Study | |
| dc.type | Journal Article | |
| dcterms.source.volume | 110 | |
| dcterms.source.startPage | 2260 | |
| dcterms.source.endPage | 2273 | |
| dcterms.source.issn | 00207608 | |
| dcterms.source.title | International Journal of Quantum Chemistry | |
| curtin.accessStatus | Fulltext not available |