| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5383941 | Chemical Physics Letters | 2011 | 7 Pages |
Abstract
⺠We describe an alternative way of designing new high-grade NLO oligomeric materials. ⺠The asymmetry of a unit cell arises from a suitable substitution on a symmetric Ï-conjugated chain. ⺠A particular attention is paid to the performance of long-range corrected DFT methods. ⺠First hyperpolarizability of PFA eicosamer is more than 5à larger than the polymeric value of PMI.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Miroslav Medved', Å imon Budzák, Tadeusz Pluta,