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http://hdl.handle.net/1942/6926
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DC Field | Value | Language |
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dc.contributor.author | MARTIN, Jan | - |
dc.contributor.author | Warshawsky, A. | - |
dc.contributor.author | Breskin, A. | - |
dc.contributor.author | Chechik, R. | - |
dc.date.accessioned | 2007-12-20T16:11:35Z | - |
dc.date.available | 2007-12-20T16:11:35Z | - |
dc.date.issued | 1997 | - |
dc.identifier.citation | Chemical physics letters, 279(5-6). p. 389-395 | - |
dc.identifier.uri | http://hdl.handle.net/1942/6926 | - |
dc.description.abstract | A number of analogs of the photosensitive molecule TMAE (tetrakis-dimethylamino-ethylene) have been investigated computationally with the goal of lowering the vertical ionization potential (IPv). This is of importance in UV-photodetectors based on gas photoionization and multiplication. The low IPv of TMAE, 6.11 eV, is shown to be due to resonance stabilization of the cation. N-substitution of phenyl groups and p-substitution of tertiary amines on the latter are found to be efficient ways of lowering IPv. The compound trans-bis-(p-dimethylaminophenyl, methyl)aminoethylene is calculated to have a IPv considerably lower than TMAE ( 5.5–5.7 eV) and appears to be a promising synthetic target. | - |
dc.language.iso | en | - |
dc.publisher | Elsevier Science B.V. | - |
dc.title | Designing low-ionization potential analogs of tetrakis-dimethylaminoethylene (TMAE) using density functional calculations | - |
dc.type | Journal Contribution | - |
dc.identifier.epage | 395 | - |
dc.identifier.issue | 5-6 | - |
dc.identifier.spage | 389 | - |
dc.identifier.volume | 279 | - |
dc.bibliographicCitation.oldjcat | - | |
dc.identifier.doi | 10.1016/S0009-2614(97)01042-7 | - |
item.accessRights | Closed Access | - |
item.fullcitation | MARTIN, Jan; Warshawsky, A.; Breskin, A. & Chechik, R. (1997) Designing low-ionization potential analogs of tetrakis-dimethylaminoethylene (TMAE) using density functional calculations. In: Chemical physics letters, 279(5-6). p. 389-395. | - |
item.contributor | MARTIN, Jan | - |
item.contributor | Warshawsky, A. | - |
item.contributor | Breskin, A. | - |
item.contributor | Chechik, R. | - |
item.fulltext | No Fulltext | - |
Appears in Collections: | Research publications |
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