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List of works by Gabriele D'Avino

Accurate Prediction of the S1 Excitation Energy in Solvated Azobenzene Derivatives via Embedded Orbital-Tuned Bethe-Salpeter Calculations

scientific article published on 04 March 2020

Aggregates of quadrupolar dyes: giant two-photon absorption from biexciton states

scientific article published on 01 December 2006

Anomalous dispersion of optical phonons at the neutral-ionic transition: evidence from diffuse x-ray scattering

scientific article published on 12 October 2007

Bistability in Fc-PTM crystals: the role of intermolecular electrostatic interactions.

scientific article published on 13 August 2008

Charge Separation and Recombination at Polymer-Fullerene Heterojunctions: Delocalization and Hybridization Effects

scientific article published on 21 January 2016

Charge dissociation at interfaces between discotic liquid crystals: the surprising role of column mismatch.

scientific article published on 10 February 2014

Charge separation energetics at organic heterojunctions: on the role of structural and electrostatic disorder

scientific article

Chasing the "Killer" Phonon Mode for the Rational Design of Low-Disorder, High-Mobility Molecular Semiconductors

scientific article published on 12 September 2019

Combining the Many-Body GW Formalism with Classical Polarizable Models: Insights on the Electronic Structure of Molecular Solids.

scientific article published on 8 July 2016

Comprehensive modelling study of singlet exciton diffusion in donor-acceptor dyads: when small changes in chemical structure matter

scientific article published on 06 November 2019

Computational Design of Thermally Activated Delayed Fluorescence Materials: The Challenges Ahead

scientific article published on 10 October 2018

Conflicting evidence for ferroelectricity.

scientific article

Dielectric properties of crystalline organic molecular films in the limit of zero overlap

scientific article published on 01 January 2016

Electronic Polarization in Organic Crystals: A Comparative Study of Induced Dipoles and Intramolecular Charge Redistribution Schemes

scientific article published on November 2014

Essential state models for solvatochromism in donor-acceptor molecules: the role of the bridge

scientific article published on 01 April 2009

Exploring the energy landscape of the charge transport levels in organic semiconductors at the molecular scale

scientific article

Fate of Low-Lying Charge-Transfer Excited States in a Donor:Acceptor Blend with a Large Energy Offset

scientific article published on 18 November 2020

Pentacene Crystal Growth on Silica and Layer-Dependent Step-Edge Barrier from Atomistic Simulations

scientific article published on 27 November 2018

Periodic potentials in hybrid van der Waals heterostructures formed by supramolecular lattices on graphene

scientific article published on 21 March 2017

Simulation of vapor-phase deposition and growth of a pentacene thin film on C60 (001)

scientific article published on 08 September 2011

Supramolecular organization of functional organic materials in the bulk and at organic/organic interfaces: a modeling and computer simulation approach

article

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