Litcius/Paper detail

Determination of self and cross contributions to the dipole–dipole correlations function from analysis of dielectric measurements

Marian Paluch, Kajetan Koperwas, Ż. Wojnarowska

2023Journal of Molecular Liquids10 citationsDOIOpen Access PDF

Abstract

The nonexponential nature of the structural relaxation is one of the most characteristic features of the molecular dynamics in glass-forming liquids. Various experimental techniques can be employed to probe this process; however, broadband dielectric spectroscopy (BDS) is the most frequently used. Based on MD simulations, we provide strong evidence of bi-modal nature of the dielectric loss peak of primary relaxation. Further, we point out that the primary dielectric relaxation process measured at constant displacement D is dominated by the self-correlation term in the dipole–dipole correlation function. In practice, it means that the dielectric spectra should be presented in the dielectric modulus representations to disclose the spectral features of the self mode.

Topics & Concepts

DielectricDipoleRelaxation (psychology)Dielectric spectroscopyCole–Cole equationMaterials scienceCorrelation function (quantum field theory)Molecular dynamicsDisplacement (psychology)Condensed matter physicsMolecular physicsNuclear magnetic resonanceChemistryComputational chemistryPhysicsPhysical chemistryOptoelectronicsElectrodeOrganic chemistryElectrochemistryPsychotherapistPsychologySocial psychologyMaterial Dynamics and PropertiesGlass properties and applicationsCultural Heritage Materials Analysis