6533b86dfe1ef96bd12c93d7
RESEARCH PRODUCT
Novel second-order nonlinear optical polymer materials containing indandione derivativatives as a chromophore
Andrejs TokmakovsMartins RutkisA. JurgisValdis KamparsEgils FonavsAivars VembrisVismants Zaulssubject
Molecular geometryAb initio quantum chemistry methodsChemistryComputational chemistrySecond-harmonic generationPhysical chemistryHyperpolarizabilityNonlinear opticsChromophoreCorona polingBasis setdescription
Second order non linear optical (NLO) properties of sPMMA based host-guest systems containing eight dimethylaminobenzylidene -1, 3 - indandione (DMABI) related chromophores have been investigated by means of quantum chemical calculations and SHG experimental characterization. Ab initio calculations with basis set 6-31G were used for molecular geometry determination as well as in the calculations of molecular hyperpolarizability by FF approach. Influence of the chromophore concentration on the host-guest film NLO performance was obtained by SHG Maker fringe experiments. The highest value of d53233 =80 pm/V (frequency corrected value d033 =12 pm/V) at chromophore concentration 15 %wt have been recorded for tret-butyl substituted DMABI chromophore.© (2006) COPYRIGHT SPIE--The International Society for Optical Engineering. Downloading of the abstract is permitted for personal use only.
| year | journal | country | edition | language |
|---|---|---|---|---|
| 2006-04-21 | SPIE Proceedings |