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An Ab Initio Description of the Excitonic Properties of LH2 and Their Temperature Dependence.The Fate of a Zwitterion in Water from ab Initio Molecular Dynamics: Monoethanolamine (MEA)-CO2.On the Metric of Charge Transfer Molecular Excitations: A Simple Chemical Descriptor.Benchmarking Time-Dependent Density Functional Theory for Excited State Geometries of Organic Molecules in Gas-Phase and in Solution.On the TD-DFT accuracy in determining single and double bonds in excited-state structures of organic molecules.Planar vs. twisted intramolecular charge transfer mechanism in Nile Red: new hints from theory.Metrics for Molecular Electronic Excitations: A Comparison between Orbital- and Density-Based Descriptors.EXAT: EXcitonic analysis tool.Circularly Polarized Luminescence from Axially Chiral BODIPY DYEmers: An Experimental and Computational Study.Excited state gradients for a state-specific continuum solvation approach: The vertical excitation model within a Lagrangian TDDFT formulation.Excited State Dipole Moments in Solution: Comparison between State-Specific and Linear-Response TD-DFT Values.Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models.Electronic Excitations in Solution: The Interplay between State Specific Approaches and a Time-Dependent Density Functional Theory Description.The Bethe-Salpeter formalism with polarisable continuum embedding: reconciling linear-response and state-specific features.Practical computation of electronic excitation in solution: vertical excitation modelControl of Coherences and Optical Responses of Pigment–Protein Complexes by Plasmonic NanoantennaeNegative solvatochromism of push–pull biphenyl compounds: a theoretical studyPlasmon Enhanced Light Harvesting: Multiscale Modeling of the FMO Protein Coupled with Gold NanoparticlesThe role of magnetic–electric coupling in exciton-coupled ECD spectra: the case of bis-phenanthrenesStructures and Properties of Electronically Excited Chromophores in Solution from the Polarizable Continuum Model Coupled to the Time-Dependent Density Functional TheoryCoupling to Charge Transfer States is the Key to Modulate the Optical Bands for Efficient Light Harvesting in Purple BacteriaFirst-principles investigation of the double ESIPT process in a thiophene-based dyeCommunication: one third: a new recipe for the PBE0 paradigmEffective electron displacements: a tool for time-dependent density functional theory computational spectroscopyAn open quantum system theory for polarizable continuum models
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description
researcher ORCID ID = 0000-0003-1924-2862
@en
wetenschapper
@nl
name
Ciro A. Guido
@ast
Ciro A. Guido
@en
Ciro A. Guido
@es
Ciro A. Guido
@nl
type
label
Ciro A. Guido
@ast
Ciro A. Guido
@en
Ciro A. Guido
@es
Ciro A. Guido
@nl
prefLabel
Ciro A. Guido
@ast
Ciro A. Guido
@en
Ciro A. Guido
@es
Ciro A. Guido
@nl
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15072889800
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0000-0003-1924-2862