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- Publisher Website: 10.1016/S0009-2614(99)01353-6
- Scopus: eid_2-s2.0-0001631326
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Article: Density functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2
| Title | Density functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2 |
|---|---|
| Authors | |
| Issue Date | 2000 |
| Publisher | Elsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cplett |
| Citation | Chemical Physics Letters, 2000, v. 316 n. 5-6, p. 524-530 How to Cite? |
| Abstract | We report density functional theory calculation results that examine the ultraviolet electronic transitions of CF 2I 2 and CH 2I 2. We make preliminary assignments of several transitions to the ultraviolet absorption spectra of CF 2I 2 and CH 2I 2. We compare our present results to previous experimental and computational work. We also examine the molecular orbitals involved in the electronic transitions assigned to the absorption spectra. |
| Persistent Identifier | http://hdl.handle.net/10722/167357 |
| ISSN | 2021 Impact Factor: 2.719 2020 SCImago Journal Rankings: 0.509 |
| ISI Accession Number ID | |
| References |
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Zheng, X | en_US |
| dc.contributor.author | Phillips, DL | en_US |
| dc.date.accessioned | 2012-10-08T03:06:00Z | - |
| dc.date.available | 2012-10-08T03:06:00Z | - |
| dc.date.issued | 2000 | en_US |
| dc.identifier.citation | Chemical Physics Letters, 2000, v. 316 n. 5-6, p. 524-530 | en_US |
| dc.identifier.issn | 0009-2614 | en_US |
| dc.identifier.uri | http://hdl.handle.net/10722/167357 | - |
| dc.description.abstract | We report density functional theory calculation results that examine the ultraviolet electronic transitions of CF 2I 2 and CH 2I 2. We make preliminary assignments of several transitions to the ultraviolet absorption spectra of CF 2I 2 and CH 2I 2. We compare our present results to previous experimental and computational work. We also examine the molecular orbitals involved in the electronic transitions assigned to the absorption spectra. | en_US |
| dc.language | eng | en_US |
| dc.publisher | Elsevier BV. The Journal's web site is located at http://www.elsevier.com/locate/cplett | en_US |
| dc.relation.ispartof | Chemical Physics Letters | en_US |
| dc.title | Density functional theory and resonance Raman investigation of the ultraviolet electronic excited states of CF2I2 | en_US |
| dc.type | Article | en_US |
| dc.identifier.email | Phillips, DL:phillips@hku.hk | en_US |
| dc.identifier.authority | Phillips, DL=rp00770 | en_US |
| dc.description.nature | link_to_subscribed_fulltext | en_US |
| dc.identifier.doi | 10.1016/S0009-2614(99)01353-6 | - |
| dc.identifier.scopus | eid_2-s2.0-0001631326 | en_US |
| dc.identifier.hkuros | 51199 | - |
| dc.relation.references | http://www.scopus.com/mlt/select.url?eid=2-s2.0-0001631326&selection=ref&src=s&origin=recordpage | en_US |
| dc.identifier.volume | 316 | en_US |
| dc.identifier.issue | 5-6 | en_US |
| dc.identifier.spage | 524 | en_US |
| dc.identifier.epage | 530 | en_US |
| dc.identifier.isi | WOS:000084960000030 | - |
| dc.publisher.place | Netherlands | en_US |
| dc.identifier.scopusauthorid | Zheng, X=7404090253 | en_US |
| dc.identifier.scopusauthorid | Phillips, DL=7404519365 | en_US |
| dc.identifier.issnl | 0009-2614 | - |