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Lista de obras de Filippo De Angelis

A Multitechnique Physicochemical Investigation of Various Factors Controlling the Photoaction Spectra and of Some Aspects of the Electron Transfer for a Series of Push–Pull Zn(II) Porphyrins Acting as Dyes in DSSCs

A Solvent Free Synthetic Route for Cerium(IV) Metal-Organic Frame-works with UiO-66 Architecture and Their Photocatalytic Application

A combined computational and experimental study of polynuclear Ru-TPPZ complexes: insight into the electronic and optical properties of coordination polymers

artículo científico publicado en 2004

A combined experimental and theoretical approach revealing a direct mechanism for bifunctional water splitting on doped copper phosphide

artículo científico publicado en 2020

A first-principles study of II–VI (II = Zn; VI = O, S, Se, Te) semiconductor nanostructures

A molecularly engineered hole-transporting material for efficient perovskite solar cells

A ruthenium tetrazole complex-based high efficiency near infrared light electrochemical cell.

artículo científico publicado en 2017

A simple synthetic route to obtain pure trans-ruthenium(II) complexes for dye-sensitized solar cell applications

artículo científico publicado en 2013

A time-dependent density functional theory investigation on the nature of the electronic transitions involved in the nonlinear optical response of [Ru(CF3CO2)3T] (T = 4'-(C6H4-p-NBu2)-2,2':6',2''-terpyridine).

artículo científico publicado en 2005

Ab Initio Simulation of the Absorption Spectra of Photoexcited Carriers in TiO2 Nanoparticles

artículo científico publicado en 2016

Ab initio molecular dynamics simulations of elimination reactions in water solution: exploring the borderline region between the E1cb and E2 reaction mechanisms

artículo científico publicado en 2006

Absorption and emission of the apigenin and luteolin flavonoids: a TDDFT investigation

artículo científico publicado en 2009

Absorption spectrum and solvatochromism of the [Ru(4,4'-COOH-2,2'-bpy)2(NCS)2] molecular dye by time dependent density functional theory

artículo científico publicado en 2003

Acetylene to vinylidene rearrangements on electron rich d6 metal centers: a density functional study

scientific article published on 27 August 2004

Acid-base properties of the N3 ruthenium(II) solar cell sensitizer: a combined experimental and computational analysis

artículo científico publicado en 2012

Adsorption of organic dyes on TiO2 surfaces in dye-sensitized solar cells: interplay of theory and experiment

artículo científico publicado en 2012

Aggregation of organic dyes on TiO2 in dye-sensitized solar cells models: an ab initio investigation

artículo científico publicado en 2010

Alignment of the dye's molecular levels with the TiO(2) band edges in dye-sensitized solar cells: a DFT-TDDFT study

artículo científico publicado en 2008

An EFISH, Theoretical, and PGSE NMR Investigation on the Relevant Role of Aggregation on the Second Order Response in CHCl3 of the Push−Pull Chromophores [5-[[4′-(Dimethylamino)phenyl]ethynyl]-15-[(4′′-nitrophenyl)ethynyl]-10,20-diphenylporph

article published in 2009

An Oxa[5]helicene-Based Racemic Semiconducting Glassy Film for Photothermally Stable Perovskite Solar Cells

scholarly article published 26 April 2019

An inconvenient influence of iridium(iii) isomer on OLED efficiency

artículo científico publicado en 2010

An integrated experimental and theoretical approach to the spectroscopy of organic-dye-sensitized TiO₂ heterointerfaces: disentangling the effects of aggregation, solvation, and surface protonation

artículo científico publicado en 2014

An investigation on the second order nonlinear optical response of tris-cyclometallated Ir(iii) complexes with variously substituted 2-phenylpyridines

article

Assessment of new gem-silanediols as suitable sensitizers for dye-sensitized solar cells

artículo científico publicado en 2013

Band Gap Engineering in MASnBr3 and CsSnBr3 Perovskites: Mechanistic Insights through the Application of Pressure

scientific article published on 19 November 2019

Band gap tuning through cation and halide alloying in mechanochemically synthesized Cs3(Sb1−xBix)2Br9 and Cs3Sb2(I1−xBrx)9 solid solutions

artículo científico publicado en 2023

Benchmarking DFT and semi-empirical methods for a reliable and cost-efficient computational screening of benzofulvene derivatives as donor materials for small-molecule organic solar cells.

artículo científico publicado en 2016

Broadband Emission in Two-Dimensional Hybrid Perovskites: The Role of Structural Deformation.

artículo científico publicado en 2016

Cation-induced band-gap tuning in organohalide perovskites: interplay of spin-orbit coupling and octahedra tilting.

artículo científico publicado en 2014

Cationic cyclometallated iridium(III) complexes with substituted 1,10-phenanthrolines: the role of the cyclometallated moiety on this new class of complexes with interesting luminescent and second order non linear optical properties

scholarly article by Claudia Dragonetti et al published 11 March 2008 in Journal of Materials Science: Materials in Electronics

Challenges in the simulation of dye-sensitized ZnO solar cells: quantum confinement, alignment of energy levels and excited state nature at the dye/semiconductor interface

artículo científico publicado en 2012

Charge Carriers Are Not Affected by the Relatively Slow-Rotating Methylammonium Cations in Lead Halide Perovskite Thin Films

scientific article published on 21 August 2019

Charge-displacement analysis for excited states

scientific article published on 01 February 2014

Chlorine Incorporation in the CH3NH3PbI3 Perovskite: Small Concentration, Big Effect.

artículo científico publicado en 2016

Clues from defect photochemistry

artículo científico publicado en 2018

Cobalt electrolyte/dye interactions in dye-sensitized solar cells: a combined computational and experimental study

scientific article published on 14 November 2012

Combined Computational and Experimental Investigation on the Nature of Hydrated Iodoplumbate Complexes: Insights into the Dual Role of Water in Perovskite Precursor Solutions

artículo científico publicado en 2020

Combined experimental and DFT-TDDFT computational study of photoelectrochemical cell ruthenium sensitizers

artículo científico publicado en 2005

Comparing the excited-state properties of a mixed-cation-mixed-halide perovskite to methylammonium lead iodide

artículo científico publicado en 2020

Computational Modeling of Isoindigo-Based Polymers Used in Organic Solar Cells

article

Computational Modeling of Stark Effects in Organic Dye-Sensitized TiO2 Heterointerfaces

scientific article published on 10 May 2011

Computational modeling of single- versus double-anchoring modes in di-branched organic sensitizers on TiO2 surfaces: structural and electronic properties

artículo científico publicado en 2014

Computational modelling of TiO2 surfaces sensitized by organic dyes with different anchoring groups: adsorption modes, electronic structure and implication for electron injection/recombination

scientific article published on 25 November 2011

Controlling competing photochemical reactions stabilizes perovskite solar cells

scholarly article

Controlling phosphorescence color and quantum yields in cationic iridium complexes: a combined experimental and theoretical study.

artículo científico publicado en 2007

Corrigendum to “Benzodithiophene based organic dyes for DSSC: Effect of alkyl chain substitution on dye efficiency”

scholarly article published in Dyes and Pigments

Cr(CO)3-activated Diels-Alder reaction on single-wall carbon nanotubes: a DFT investigation

artículo científico publicado en 2009

Critical Role of Protons for Emission Quenching of Indoline Dyes in Solution and on Semiconductor Surfaces

artículo científico publicado en 2020

Cyclometalated Ir(III) complexes with substituted 1,10-phenanthrolines: a new class of efficient cationic organometallic second-order NLO chromophores

artículo científico publicado en 2010

Cyclometalated iridium(III) complexes based on phenyl-imidazole ligand

artículo científico publicado en 2010

Cyclometallated iridium(III) complexes with substituted 1,10-phenanthrolines: a new class of highly active organometallic second order NLO-phores with excellent transparency with respect to second harmonic emission

artículo científico publicado en 2007

DFT/TDDFT investigation of the stepwise deprotonation in tetracycline: pKa assignment and UV–vis spectroscopy

artículo científico publicado en 2012

DFT/TDDFT study of the adsorption of N3 and N719 dyes on ZnO(101̅0) surfaces

artículo científico publicado en 2014

Decoding ultrafast polarization responses in lead halide perovskites by the two-dimensional optical Kerr effect

artículo científico publicado en 2021

Defect Activity in Lead Halide Perovskites

scientific article published on 18 August 2019

Defect migration in methylammonium lead iodide and its role in perovskite solar cell operation

Defect-Assisted Photoinduced Halide Segregation in Mixed-Halide Perovskite Thin Films

artículo científico publicado en 2017

Density Relaxation in Time-Dependent Density Functional Theory: Combining Relaxed Density Natural Orbitals and Multireference Perturbation Theories for an Improved Description of Excited States

artículo científico publicado en 2014

Dynamical Origin of the Rashba Effect in Organohalide Lead Perovskites: A Key to Suppressed Carrier Recombination in Perovskite Solar Cells?

artículo científico publicado en 2016

Effect of Molecular Fluctuations on Hole Diffusion within Dye Monolayers

Effect of Structural Dynamics on the Opto-Electronic Properties of Bare and Hydrated ZnS QDs

article

Efficient far red sensitization of nanocrystalline TiO2 films by an unsymmetrical squaraine dye.

artículo científico publicado en 2007

Electrochemical Hole Injection Selectively Expels Iodide from Mixed Halide Perovskite Films

artículo científico publicado en 2019

Electron-rich heteroaromatic conjugated bipyridine based ruthenium sensitizer for efficient dye-sensitized solar cells

artículo científico publicado en 2008

Electronic Properties and Carrier Trapping in Bi and Mn Co-Doped CsPbCl3 Perovskite

scientific article published on 17 June 2020

Electronic Transitions Involved in the Absorption Spectrum and Dual Luminescence of Tetranuclear Cubane [Cu4I4(pyridine)4] Cluster: a Density Functional Theory/Time-Dependent Density Functional Theory Investigation

artículo científico publicado en 2006

Electronic and optical properties of MAPbX3 perovskites (X = I, Br, Cl): a unified DFT and GW theoretical analysis

artículo científico publicado en 2016

Electronic and optical properties of dye-sensitized TiO₂ interfaces

artículo científico

Electronic structure of MAPbI3 and MAPbCl3: importance of band alignment

artículo científico publicado en 2019

Elusive Presence of Chloride in Mixed Halide Perovskite Solar Cells.

artículo científico publicado en 2014

Energy levels, charge injection, charge recombination and dye regeneration dynamics for donor–acceptor π-conjugated organic dyes in mesoscopic TiO2 sensitized solar cells

artículo científico publicado en 2011

Engineering of Ru(ii) dyes for interfacial and light-harvesting optimization

artículo científico publicado en 2014

Engineering of thiocyanate-free Ru(ii) sensitizers for high efficiency dye-sensitized solar cells

artículo científico publicado en 2013

Evidence of a borderline region between E1cb and E2 elimination reaction mechanisms: a combined experimental and theoretical study of systems activated by the pyridine ring.

artículo científico publicado en 2005

Exploring the Limits of Three-Dimensional Perovskites: The Case of FAPb1–xSnxBr3

article published in 2018

Extremely Slow Photoconductivity Response of CH3NH3PbI3 Perovskites Suggesting Structural Changes under Working Conditions.

artículo científico publicado en 2014

Ferroelectric Polarization of CH3NH3PbI3: A Detailed Study Based on Density Functional Theory and Symmetry Mode Analysis

artículo científico publicado en 2015

First-Principles Computational Modeling of Fluorescence Resonance Energy Transfer in Co-Sensitized Dye Solar Cells.

artículo científico publicado en 2012

First-Principles Investigation of the TiO2/Organohalide Perovskites Interface: The Role of Interfacial Chlorine

scientific article published on 22 July 2014

First-Principles Modeling of Defects in Lead Halide Perovskites: Best Practices and Open Issues

scholarly article

First-Principles Modeling of Mixed Halide Organometal Perovskites for Photovoltaic Applications

article

First-Principles Modeling of a Dye-Sensitized TiO2/IrO2 Photoanode for Water Oxidation

artículo científico publicado en 2015

Fluorescent Alloy CsPb x Mn1-x I3 Perovskite Nanocrystals with High Structural and Optical Stability.

artículo científico publicado en 2017

Fluorinated beta-diketonate diglyme lanthanide complexes as new second-order nonlinear optical chromophores: the role of f electrons in the dipolar and octupolar contribution to quadratic hyperpolarizability.

artículo científico publicado en 2010

Formation of Surface Defects Dominates Ion Migration in Lead-Halide Perovskites

artículo científico publicado en 2019

From Large to Small Polarons in Lead, Tin, and Mixed Lead-Tin Halide Perovskites

scientific article published on 02 April 2019

Functionalized Ruthenium Dialkynyl Complexes with High Second-Order Nonlinear Optical Properties and Good Potential as Dye Sensitizers for Solar Cells

article by Filippo Nisic et al published 23 December 2014 in Organometallics

Globularity-Selected Large Molecules for a New Generation of Multication Perovskites

artículo científico publicado en 2017

Graphene–organic hybrids as processable, tunable platforms for pH-dependent photoemission, obtained by a new modular approach

article

Hierarchical Coherent Phonons in a Superatomic Semiconductor

scientific article published on 25 July 2019

High Open-Circuit Voltages: Evidence for a Sensitizer-Induced TiO2 Conduction Band Shift in Ru(II)-Dye Sensitized Solar Cells

article

High open-circuit voltage solid-state dye-sensitized solar cells with organic dye.

artículo científico

Highly stable 7-N,N-dibutylamino-2-azaphenanthrene and 8-N,N-dibutylamino-2-azachrysene as a new class of second order NLO-active chromophores

artículo científico publicado en 2010

Impact of Spin-Orbit Coupling on Photocurrent Generation in Ruthenium Dye-Sensitized Solar Cells

artículo científico publicado en 2014

Influence of Disorder and Anharmonic Fluctuations on the Dynamical Rashba Effect in Purely Inorganic Lead-Halide Perovskites

artículo científico publicado en 2018

Influence of Donor Groups of Organic D−π–A Dyes on Open-Circuit Voltage in Solid-State Dye-Sensitized Solar Cells

article

Influence of the sensitizer adsorption mode on the open-circuit potential of dye-sensitized solar cells

artículo científico publicado en 2007

Infrared Dielectric Screening Determines the Low Exciton Binding Energy of Metal-Halide Perovskites

artículo científico publicado en 2018

Interface Electrostatics of Solid-State Dye-Sensitized Solar Cells: A Joint Drift-Diffusion and Density Functional Theory Study

scholarly article

Intermolecular Interactions in Dye-Sensitized Solar Cells: A Computational Modeling Perspective

artículo científico publicado en 2013

Intrinsic Halide Segregation at Nanometer Scale Determines the High Efficiency of Mixed Cation/Mixed Halide Perovskite Solar Cells

artículo científico publicado en 2016

Introduction of a Bifunctional Cation Affords Perovskite Solar Cells Stable at Temperatures Exceeding 80 °C

artículo científico publicado en 2019

Ionotronic Halide Perovskite Drift-Diffusive Synapses for Low-Power Neuromorphic Computation

scientific article published on 17 October 2018

Large electrostrictive response in lead halide perovskites

artículo científico publicado en 2018

Large polaron evidence in the ultrafast THz response of Lead-Halide Perovskites

artículo científico publicado en 2019

Large polarons in lead halide perovskites

artículo científico publicado en 2017

Ligand Engineering for the Efficient Dye-Sensitized Solar Cells with Ruthenium Sensitizers and Cobalt Electrolytes

artículo científico publicado en 2016

Ligand-Induced Surface Charge Density Modulation Generates Local Type-II Band Alignment in Reduced-Dimensional Perovskites

artículo científico publicado en 2019

Light-induced annihilation of Frenkel defects in organo-lead halide perovskites

article by Edoardo Mosconi et al published 2016 in Energy and Environmental Science

Long-Lived Photoinduced Polarons in Organohalide Perovskites

artículo científico publicado en 2017

Luminescent cyclometallated Ir(III) and Pt(II) complexes with beta-diketonate ligands as highly active second-order NLO chromophores

artículo científico publicado en 2010

Measured binding coefficients for iodine and ruthenium dyes; implications for recombination in dye sensitised solar cells.

artículo científico publicado en 2012

Mechanism of the Initial Conformational Transition of a Photomodulable Peptide

artículo científico publicado en 2005

Metal-Free Benzodithiophene-Containing Organic Dyes for Dye-Sensitized Solar Cells

artículo científico publicado en 2012

Migration of cations induces reversible performance losses over day/night cycling in perovskite solar cells

article

Modeling materials and processes in dye-sensitized solar cells: understanding the mechanism, improving the efficiency

artículo científico

Modulating the electronic properties of asymmetric push–pull and symmetric Zn(II)-diarylporphyrinates with para substituted phenylethynyl moieties in 5,15 meso positions: A combined electrochemical and spectroscopic investigation

Molecular engineering of organic sensitizers for dye-sensitized solar cell applications

artículo científico publicado en 2008

Molecular engineering of organic sensitizers for solar cell applications

artículo científico publicado en 2006

Monitoring the intramolecular charge transfer process in the Z907 solar cell sensitizer: a transient Vis and IR spectroscopy and ab initio investigation

artículo científico publicado en 2015

Nearly Monodisperse Insulator Cs4PbX6 (X = Cl, Br, I) Nanocrystals, Their Mixed Halide Compositions, and Their Transformation into CsPbX3 Nanocrystals.

artículo científico publicado en 2017

New [(D-terpyridine)-Ru-(D or A-terpyridine)][4-EtPhCO2]2 complexes (D = electron donor group; A = electron acceptor group) as active second-order non linear optical chromophores

artículo científico publicado en 2012

New thiocyanate-free ruthenium(II) sensitizers with different pyrid-2-yl tetrazolate ligands for dye-sensitized solar cells

artículo científico publicado en 2015

Novel carbazole-phenothiazine dyads for dye-sensitized solar cells: a combined experimental and theoretical study.

artículo científico publicado en 2013

Novel heteroleptic Ru(II) complexes: synthesis, characterization and application in dye-sensitized solar cells

scientific article published on 01 March 2015

Oligothiophenes nano-organized on a cyclotetrasiloxane scaffold as a model of a silica-bound monolayer: evidence for intramolecular excimer formation

artículo científico publicado en 2009

Panchromatic cross-substituted squaraines for dye-sensitized solar cell applications

artículo científico publicado en 2009

Panchromatic ruthenium sensitizer based on electron-rich heteroarylvinylene π-conjugated quaterpyridine for dye-sensitized solar cells

scientific article published on 16 November 2010

Penning ionization of N2O molecules by He*(2(3,1)S) and Ne*(3P2,0) metastable atoms: a crossed beam study

artículo científico publicado en 2005

Penning ionization of N2O molecules by He*(2(3,1)S) and Ne*(3P2,0) metastable atoms: theoretical considerations about the intermolecular interactions

scientific article published on 01 April 2005

Permanent excimer superstructures by supramolecular networking of metal quantum clusters

artículo científico publicado en 2016

Photoinduced Energy Shift in Quantum-Dot-Sensitized TiO2: A First-Principles Analysis

artículo científico publicado en 2015

Photoinduced Reversible Structural Transformations in Free-Standing CH3NH3PbI3 Perovskite Films

scientific article published on 08 June 2015

Photophysical properties of [Ru(phen)2(dppz)]2+ intercalated into DNA: an integrated Car-Parrinello and TDDFT study

artículo científico publicado en 2005

Physicochemical Investigation of the Panchromatic Effect on β-Substituted ZnII Porphyrinates for DSSCs: The Role of the π Bridge between a Dithienylethylene Unit and the Porphyrinic Ring

Publisher Correction: Large electrostrictive response in lead halide perovskites

artículo científico publicado en 2018

Quantitative structure–property relationship modeling of ruthenium sensitizers for solar cells applications: novel tools for designing promising candidates

scholarly article by Sara Tortorella et al published 2015 in RSC Advances

Quaterpyridine ligands for panchromatic Ru(II) dye sensitizers

artículo científico publicado en 2012

Rashba Band Splitting in Organohalide Lead Perovskites: Bulk and Surface Effects.

artículo científico publicado en 2017

Rationalizing the Molecular Design of Hole‐Selective Contacts to Improve Charge Extraction in Perovskite Solar Cells

scholarly article

Relativistic GW calculations on CH3NH3PbI3 and CH3NH3SnI3 perovskites for solar cell applications.

artículo científico publicado en 2014

Role of Hot Singlet Excited States in Charge Generation at the Black Dye/TiO2 Interface

artículo científico publicado en 2013

Ruthenium sensitizers based on heteroaromatic conjugated bypiridines for dye-sensitized solar cells

Science in the Age of Digital Networking

artículo científico publicado en 2015

Shape and morphology effects on the electronic structure of TiO(2) nanostructures: from nanocrystals to nanorods

artículo científico publicado en 2014

Solution Synthesis Approach to Colloidal Cesium Lead Halide Perovskite Nanoplatelets with Monolayer-Level Thickness Control.

artículo científico publicado en 2016

Solvent-Free Synthetic Route for Cerium(IV) Metal-Organic Frameworks with UiO-66 Architecture and Their Photocatalytic Applications

scientific article published on 21 November 2019

Spider-like oligothiophenes

artículo científico publicado en 2008

Stabilizing halide perovskite surfaces for solar cell operation with wide-bandgap lead oxysalts

artículo científico publicado en 2019

Stable Ligand Coordination at the Surface of Colloidal CsPbBr3 Nanocrystals

artículo científico publicado en 2019

Stark effect in perovskite/TiO2 solar cells: evidence of local interfacial order

artículo científico publicado en 2014

Structural and Optical Properties of Solvated PbI2 in γ-Butyrolactone: Insight into the Solution Chemistry of Lead Halide Perovskite Precursors

artículo científico publicado en 2020

Structural and electronic properties of organo-halide hybrid perovskites from ab initio molecular dynamics

artículo científico publicado en 2015

Structural and electronic properties of organo-halide lead perovskites: a combined IR-spectroscopy and ab initio molecular dynamics investigation

artículo científico publicado en 2014

Structural and electronic properties of photoexcited TiO2 nanoparticles from first principles

artículo científico publicado en 2015

Structural and optical properties of methylammonium lead iodide across the tetragonal to cubic phase transition: implications for perovskite solar cells

Superatomic Two-Dimensional Semiconductor

artículo científico publicado en 2018

Synthesis by MW-assisted direct arylation, side-arms driven self-assembly and functional properties of 9,10-dithienylanthracene orthogonal materials

Synthesis, Characterization, and DFT-TDDFT Computational Study of a Ruthenium Complex Containing a Functionalized Tetradentate Ligand

artículo científico publicado en 2006

Synthesis, characterization, and DFT/TD-DFT calculations of highly phosphorescent blue light-emitting anionic iridium complexes

artículo científico publicado en 2008

Synthesis, size-dependent optoelectronic and charge transport properties of thieno(bis)imide end-substituted molecular semiconductors

Terpyridine Zn(II), Ru(III), and Ir(III) complexes: the relevant role of the nature of the metal ion and of the ancillary ligands on the second-order nonlinear response of terpyridines carrying electron donor or electron acceptor groups.

artículo científico publicado en 2005

Tetraaryl ZnII porphyrinates substituted at β-pyrrolic positions as sensitizers in dye-sensitized solar cells: a comparison with meso-disubstituted push-pull Zn(II) porphyrinates.

artículo científico publicado en 2013

The Doping Mechanism of Halide Perovskite Unveiled by Alkaline Earth Metals

scientific article published on 24 January 2020

The Impact of the Crystallization Processes on the Structural and Optical Properties of Hybrid Perovskite Films for Photovoltaics

The Impact of the Crystallization Processes on the Structural and Optical Properties of Hybrid Perovskite Films for Photovoltaics

The Raman Spectrum of the CH3NH3PbI3 Hybrid Perovskite: Interplay of Theory and Experiment.

artículo científico publicado en 2013

The effect of TiO2 surface on the electron injection efficiency in PbS quantum dot solar cells: a first-principles study

The nature of the lead-iodine bond in PbI2: A case study for the modelling of lead halide perovskites

scholarly article

The role of 5-R-1,10-phenanthroline (R=CH3, NO2) on the emission properties and second-order NLO response of cationic Ir(III) organometallic chromophores

article

The role of substituents on functionalized 1,10-phenanthroline in controlling the emission properties of cationic iridium(III) complexes of interest for electroluminescent devices

artículo científico publicado en 2007

The unexpected similar second-order NLO response for nearly planar and largely twisted push-pull stilbazole chromophores: EFISH and theoretical TD-DFT evidence.

artículo científico publicado en 2005

Theoretical Investigations of the Effects of J-Aggregation on the Linear and Nonlinear Optical Properties ofE-4-(4-Dimethylaminostyryl)-1-methylpyridinium [DAMS+]

Theoretical studies on anatase and less common TiO2 phases: bulk, surfaces, and nanomaterials

artículo científico publicado en 2014

Thermal Fluctuations on Förster Resonance Energy Transfer in Dyadic Solar Cell Sensitizers: A Combined Ab Initio Molecular Dynamics and TDDFT Investigation

Thiocyanate-Free Ruthenium(II) Sensitizers for Dye-Sensitized Solar Cells Based on the Cobalt Redox Couple

artículo científico publicado en 2014

Thiocyanate-free ruthenium(II) sensitizer with a pyrid-2-yltetrazolate ligand for dye-sensitized solar cells

artículo científico publicado en 2013

Time-dependent DFT study of [Fe(CN)6]4- sensitization of TiO2 nanoparticles

artículo científico publicado en 2004

Time-dependent and coupled-perturbed DFT and HF investigations on the absorption spectrum and non-linear optical properties of push–pull M(II)–porphyrin complexes (M=Zn, Cu, Ni)

Time-dependent density functional theory investigations on the excited states of Ru(II)-dye-sensitized TiO2 nanoparticles: the role of sensitizer protonation

artículo científico publicado en 2007

Tin versus Lead Redox Chemistry Modulates Charge Trapping and Self-Doping in Tin/Lead Iodide Perovskites

artículo científico publicado en 2020

Titanium Dioxide Nanomaterials for Photovoltaic Applications

artículo científico publicado en 2014

Towards molecular design rationalization in branched multi-thiophene semiconductors: the 2-thienyl-persubstituted alpha-oligothiophenes

artículo científico publicado en 2010

Transition Dipole Moments of n = 1, 2, and 3 Perovskite Quantum Wells from the Optical Stark Effect and Many-Body Perturbation Theory

scientific article published on 15 January 2020

Trends in Perovskite Solar Cells and Optoelectronics: Status of Research and Applications from the PSCO Conference

Tuning the Dipolar Second-Order Nonlinear Optical Properties of Cyclometalated Platinum(II) Complexes with Tridentate N^C^N Binding Ligands

artículo científico publicado en 2013

Ultrafast THz Probe of Photoinduced Polarons in Lead-Halide Perovskites

artículo científico publicado en 2019

Unexpectedly high second-order nonlinear optical properties of simple Ru and Pt alkynyl complexes as an analytical springboard for NLO-active polymer films

artículo científico publicado en 2014

Vibrational Response of Methylammonium Lead Iodide: From Cation Dynamics to Phonon-Phonon Interactions.

artículo científico publicado en 2016

Water Oxidation by the [Co4O4(OAc)4(py)4](+) Cubium is Initiated by OH(-) Addition.

artículo científico publicado en 2015

Water-Stable DMASnBr3 Lead-Free Perovskite for Effective Solar-Driven Photocatalysis

artículo científico publicado en 2020

White-light phosphorescence emission from a single molecule: application to OLED

artículo científico publicado en 2009

π-Core tailoring for new high performance thieno(bis)imide based n-type molecular semiconductors

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