Lista de obras - Claudine Katan - Dominio Público Uruguay

A close examination of the structure and dynamics of HC(NH2)2PbI3 by MD simulations and group theory.

artículo científico publicado en 2016

Absorption and fluorescence signatures of 1,2,3-triazole based regioisomers: challenging compounds for TD-DFT

Advances and Promises of Layered Halide Hybrid Perovskite Semiconductors

artículo científico publicado en 2016

Anharmonicity and Disorder in the Black Phases of Cesium Lead Iodide Used for Stable Inorganic Perovskite Solar Cells

artículo científico publicado en 2018

Caged glutamates with π-extended 1,2-dihydronaphthalene chromophore: design, synthesis, two-photon absorption property, and photochemical reactivity

artículo científico publicado en 2014

Cation Alloying Delocalizes Polarons in Lead Halide Perovskites

artículo científico publicado en 2019

Cation Engineering in Two-Dimensional Ruddlesden-Popper Lead Iodide Perovskites with Mixed Large A-Site Cations in the Cages

artículo científico publicado en 2020

Charge instability in quadrupolar chromophores: symmetry breaking and solvatochromism

artículo científico publicado en 2006

Comment on "Density functional theory analysis of structural and electronic properties of orthorhombic perovskite CH3NH3PbI3" by Y. Wang et al., Phys. Chem. Chem. Phys., 2014, 16, 1424-1429

artículo científico publicado en 2014

Composite Nature of Layered Hybrid Perovskites: Assessment on Quantum and Dielectric Confinements and Band Alignment.

artículo científico publicado en 2018

Concept of Lattice Mismatch and Emergence of Surface States in Two-dimensional Hybrid Perovskite Quantum Wells

artículo científico publicado en 2018

Control of Crystal Symmetry Breaking with Halogen-Substituted Benzylammonium in Layered Hybrid Metal-Halide Perovskites

artículo científico publicado en 2020

Critical Role of Interface and Crystallinity on the Performance and Photostability of Perovskite Solar Cell on Nickel Oxide

artículo científico publicado en 2017

Decreasing the electronic confinement in layered perovskites through intercalation.

artículo científico publicado en 2016

Design and Synthesis of a 4-Nitrobromobenzene Derivative Bearing an Ethylene Glycol Tetraacetic Acid Unit for a New Generation of Caged Calcium Compounds with Two-Photon Absorption Properties in the Near-IR Region and Their Application in Vivo

artículo científico publicado en 2016

Design and Synthesis of a Caged Carboxylic Acid with a Donor-π-Donor Coumarin Structure: One-photon and Two-photon Uncaging Reactions Using Visible and Near-Infrared Lights.

artículo científico publicado en 2017

Design and synthesis of a new chromophore, 2-(4-nitrophenyl)benzofuran, for two-photon uncaging using near-IR light

artículo científico publicado en 2015

Designing a New Two-Dimensional Molecular Layout by Hydrogen Bonding

artículo científico publicado en 2006

Does Rashba splitting in CH3NH3PbBr3 arise from 2 × 2 surface reconstruction?

artículo científico publicado en 2018

Effect of branching on two-photon absorption in triphenylbenzene derivatives

artículo científico publicado en 2007

Effects of (multi)branching of dipolar chromophores on photophysical properties and two-photon absorption

artículo científico publicado en 2005

Effects of dipolar interactions on linear and nonlinear optical properties of multichromophore assemblies: a case study.

artículo científico publicado en 2006

Elastic Constants, Optical Phonons, and Molecular Relaxations in the High Temperature Plastic Phase of the CH3NH3PbBr3 Hybrid Perovskite

artículo científico publicado en 2016

Elastic Softness of Hybrid Lead Halide Perovskites

scientific article published on 01 August 2018

Electronic properties of Pb-I deficient lead halide perovskites

artículo científico publicado en 2019

Enhanced Stability and Band Gap Tuning of α-[HC(NH2)2]PbI3 Hybrid Perovskite by Large Cation Integration

scientific article published on 30 May 2019

Entropy in halide perovskites

artículo científico publicado en 2018

Experimental and theoretical studies of quadrupolar oligothiophene-cored chromophores containing dimesitylboryl moieties as π-accepting end-groups: syntheses, structures, fluorescence, and one- and two-photon absorption.

artículo científico publicado en 2014

Extremely efficient internal exciton dissociation through edge states in layered 2D perovskites.

artículo científico publicado en 2017

First-principles molecular-dynamics simulations for neutral p-chloranil and its radical anion

artículo científico publicado en 1996

From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer

artículo científico publicado en 2019

Geometry Distortion and Small Polaron Binding Energy Changes with Ionic Substitution in Halide Perovskites

artículo científico publicado en 2018

Guanidinium and Mixed Cesium-Guanidinium Tin(II) Bromides: Effects of Quantum Confinement and Out-of-Plane Octahedral Tilting

artículo científico publicado en 2019

Halide Perovskites: Low Dimensions for Devices

artículo científico publicado en 2019

High Members of the 2D Ruddlesden-Popper Halide Perovskites: Synthesis, Optical Properties, and Solar Cells of (CH 3 (CH 2 ) 3 NH 3 ) 2 (CH 3 NH 3 ) 4 Pb 5 I 16

High-yield formation of substituted tetracyanobutadienes from reaction of ynamides with tetracyanoethylene.

artículo científico publicado en 2014

Hybrid Dion-Jacobson 2D Lead Iodide Perovskites.

artículo científico publicado en 2018

Importance of Vacancies and Doping in the Hole-Transporting Nickel Oxide Interface with Halide Perovskites

artículo científico publicado en 2020

Improved transparency--nonlinearity trade-off with boroxine-based octupolar molecules

scientific article published on 01 November 2003

Light-activated photocurrent degradation and self-healing in perovskite solar cells

artículo científico publicado en 2016

Luminescence Behavior of Protonated Methoxy-Substituted Diazine Derivatives: Toward White Light Emission

Molecular disorder and translation/rotation coupling in the plastic crystal phase of hybrid perovskites.

artículo científico publicado en 2015

Multinuclear NMR as a tool for studying local order and dynamics in CH3NH3PbX3 (X = Cl, Br, I) hybrid perovskites.

artículo científico publicado en 2016

Negative Pressure Engineering with Large Cage Cations in 2D Halide Perovskites Causes Lattice Softening

artículo científico publicado en 2020

New Type of 2D Perovskites with Alternating Cations in the Interlayer Space, (C(NH2)3)(CH3NH3)nPbnI3n+1: Structure, Properties, and Photovoltaic Performance

artículo científico publicado en 2017

Nonlinear optical properties of intriguing Ru σ-acetylide complexes and the use of a photocrosslinked polymer as a springboard to obtain SHG active thin films

artículo científico publicado en 2016

Novel chromophores from alternated pyridine-ethylenedioxythiophene unit oligomers: dramatic enhancement of photoluminescence properties in elongated derivatives

artículo científico publicado en 2008

On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA

artículo científico publicado en 2007

On the contribution of f electrons to the quadratic hyperpolarizability: the case of lanthanide terpyridyl complexes.

artículo científico publicado en 2018

Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb2Br7

artículo científico publicado en 2020

Photoisomerisation in Aminoazobenzene-Substituted Ruthenium(II) Tris(bipyridine) Complexes: Influence of the Conjugation Pathway

artículo científico publicado en 2015

Polaron Stabilization by Cooperative Lattice Distortion and Cation Rotations in Hybrid Perovskite Materials

artículo científico publicado en 2016

Position Isomerism on One and Two Photon Absorption in Multibranched Chromophores: A TDDFT Investigation

artículo científico publicado en 2010

Quantum and Dielectric Confinement Effects in Lower-Dimensional Hybrid Perovskite Semiconductors

artículo científico publicado en 2019

Quantum confinement and dielectric profiles of colloidal nanoplatelets of halide inorganic and hybrid organic-inorganic perovskites

artículo científico publicado en 2016

Rashba and Dresselhaus Effects in Hybrid Organic-Inorganic Perovskites: From Basics to Devices

scientific article published on 14 September 2015

Scaling law for excitons in 2D perovskite quantum wells.

artículo científico publicado en 2018

Simultaneous control of emission localization and two-photon absorption efficiency in dissymmetrical chromophores.

artículo científico publicado en 2010

Structural Diversity in White-Light-Emitting Hybrid Lead Bromide Perovskites

article by Lingling Mao et al published 13 September 2018 in Journal of the American Chemical Society

Structural and thermodynamic limits of layer thickness in 2D halide perovskites

artículo científico publicado en 2018

Symmetry-Based Tight Binding Modeling of Halide Perovskite Semiconductors.

artículo científico publicado en 2016

The importance of relativistic effects on two-photon absorption spectra in metal halide perovskites

scientific article published on 25 November 2019

The synthesis and one- and two-photon optical properties of dipolar, quadrupolar and octupolar donor-acceptor molecules containing dimesitylboryl groups

artículo científico publicado en 2009

Three-Dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse

artículo científico publicado en 2020

Tunable White-Light Emission in Single-Cation-Templated Three-Layered 2D Perovskites (CH3CH2NH3)4Pb3Br10-xClx

artículo científico publicado en 2017

Tuning Electronic Structure in Layered Hybrid Perovskites with Organic Spacer Substitution

scientific article published on 08 November 2019

Two-Dimensional Dion-Jacobson Hybrid Lead Iodide Perovskites with Aromatic Diammonium Cations

scientific article published on 31 July 2019

Two-Dimensional Halide Perovskites Incorporating Straight Chain Symmetric Diammonium Ions, (NH3CmH2mNH3)(CH3NH3)n−1PbnI3n+1 (m = 4–9; n = 1–4)

scientific article published on 18 September 2018

Two-photon transitions in quadrupolar and branched chromophores: experiment and theory

artículo científico publicado en 2007

Understanding quantum confinement of charge carriers in layered 2D hybrid perovskites

artículo científico publicado en 2014

Vibronic coupling to simulate the phosphorescence spectra of Ir(III)-based OLED systems: TD-DFT results meet experimental data.

artículo científico publicado en 2016

Lista de obras de Claudine Katan

A close examination of the structure and dynamics of HC(NH2)2PbI3 by MD simulations and group theory.

Absorption and fluorescence signatures of 1,2,3-triazole based regioisomers: challenging compounds for TD-DFT

Advances and Promises of Layered Halide Hybrid Perovskite Semiconductors

Anharmonicity and Disorder in the Black Phases of Cesium Lead Iodide Used for Stable Inorganic Perovskite Solar Cells

Caged glutamates with π-extended 1,2-dihydronaphthalene chromophore: design, synthesis, two-photon absorption property, and photochemical reactivity

Cation Alloying Delocalizes Polarons in Lead Halide Perovskites

Cation Engineering in Two-Dimensional Ruddlesden-Popper Lead Iodide Perovskites with Mixed Large A-Site Cations in the Cages

Charge instability in quadrupolar chromophores: symmetry breaking and solvatochromism

Comment on "Density functional theory analysis of structural and electronic properties of orthorhombic perovskite CH3NH3PbI3" by Y. Wang et al., Phys. Chem. Chem. Phys., 2014, 16, 1424-1429

Composite Nature of Layered Hybrid Perovskites: Assessment on Quantum and Dielectric Confinements and Band Alignment.

Concept of Lattice Mismatch and Emergence of Surface States in Two-dimensional Hybrid Perovskite Quantum Wells

Control of Crystal Symmetry Breaking with Halogen-Substituted Benzylammonium in Layered Hybrid Metal-Halide Perovskites

Critical Role of Interface and Crystallinity on the Performance and Photostability of Perovskite Solar Cell on Nickel Oxide

Decreasing the electronic confinement in layered perovskites through intercalation.

Design and Synthesis of a 4-Nitrobromobenzene Derivative Bearing an Ethylene Glycol Tetraacetic Acid Unit for a New Generation of Caged Calcium Compounds with Two-Photon Absorption Properties in the Near-IR Region and Their Application in Vivo

Design and Synthesis of a Caged Carboxylic Acid with a Donor-π-Donor Coumarin Structure: One-photon and Two-photon Uncaging Reactions Using Visible and Near-Infrared Lights.

Design and synthesis of a new chromophore, 2-(4-nitrophenyl)benzofuran, for two-photon uncaging using near-IR light

Designing a New Two-Dimensional Molecular Layout by Hydrogen Bonding

Does Rashba splitting in CH3NH3PbBr3 arise from 2 × 2 surface reconstruction?

Effect of branching on two-photon absorption in triphenylbenzene derivatives

Effects of (multi)branching of dipolar chromophores on photophysical properties and two-photon absorption

Effects of dipolar interactions on linear and nonlinear optical properties of multichromophore assemblies: a case study.

Elastic Constants, Optical Phonons, and Molecular Relaxations in the High Temperature Plastic Phase of the CH3NH3PbBr3 Hybrid Perovskite

Elastic Softness of Hybrid Lead Halide Perovskites

Electronic properties of Pb-I deficient lead halide perovskites

Enhanced Stability and Band Gap Tuning of α-[HC(NH2)2]PbI3 Hybrid Perovskite by Large Cation Integration

Entropy in halide perovskites

Experimental and theoretical studies of quadrupolar oligothiophene-cored chromophores containing dimesitylboryl moieties as π-accepting end-groups: syntheses, structures, fluorescence, and one- and two-photon absorption.

Extremely efficient internal exciton dissociation through edge states in layered 2D perovskites.

First-principles molecular-dynamics simulations for neutral p-chloranil and its radical anion

From 2D to 1D Electronic Dimensionality in Halide Perovskites with Stepped and Flat Layers Using Propylammonium as a Spacer

Geometry Distortion and Small Polaron Binding Energy Changes with Ionic Substitution in Halide Perovskites

Guanidinium and Mixed Cesium-Guanidinium Tin(II) Bromides: Effects of Quantum Confinement and Out-of-Plane Octahedral Tilting

Halide Perovskites: Low Dimensions for Devices

High Members of the 2D Ruddlesden-Popper Halide Perovskites: Synthesis, Optical Properties, and Solar Cells of (CH 3 (CH 2 ) 3 NH 3 ) 2 (CH 3 NH 3 ) 4 Pb 5 I 16

High-yield formation of substituted tetracyanobutadienes from reaction of ynamides with tetracyanoethylene.

Hybrid Dion-Jacobson 2D Lead Iodide Perovskites.

Importance of Vacancies and Doping in the Hole-Transporting Nickel Oxide Interface with Halide Perovskites

Improved transparency--nonlinearity trade-off with boroxine-based octupolar molecules

Light-activated photocurrent degradation and self-healing in perovskite solar cells

Luminescence Behavior of Protonated Methoxy-Substituted Diazine Derivatives: Toward White Light Emission

Molecular disorder and translation/rotation coupling in the plastic crystal phase of hybrid perovskites.

Multinuclear NMR as a tool for studying local order and dynamics in CH3NH3PbX3 (X = Cl, Br, I) hybrid perovskites.

Negative Pressure Engineering with Large Cage Cations in 2D Halide Perovskites Causes Lattice Softening

New Type of 2D Perovskites with Alternating Cations in the Interlayer Space, (C(NH2)3)(CH3NH3)nPbnI3n+1: Structure, Properties, and Photovoltaic Performance

Nonlinear optical properties of intriguing Ru σ-acetylide complexes and the use of a photocrosslinked polymer as a springboard to obtain SHG active thin films

Novel chromophores from alternated pyridine-ethylenedioxythiophene unit oligomers: dramatic enhancement of photoluminescence properties in elongated derivatives

On the accurate estimation of intermolecular interactions and charge transfer: the case of TTF-CA

On the contribution of f electrons to the quadratic hyperpolarizability: the case of lanthanide terpyridyl complexes.

Organic Cation Alloying on Intralayer A and Interlayer A' sites in 2D Hybrid Dion-Jacobson Lead Bromide Perovskites (A')(A)Pb2Br7

Photoisomerisation in Aminoazobenzene-Substituted Ruthenium(II) Tris(bipyridine) Complexes: Influence of the Conjugation Pathway

Polaron Stabilization by Cooperative Lattice Distortion and Cation Rotations in Hybrid Perovskite Materials

Position Isomerism on One and Two Photon Absorption in Multibranched Chromophores: A TDDFT Investigation

Quantum and Dielectric Confinement Effects in Lower-Dimensional Hybrid Perovskite Semiconductors

Quantum confinement and dielectric profiles of colloidal nanoplatelets of halide inorganic and hybrid organic-inorganic perovskites

Rashba and Dresselhaus Effects in Hybrid Organic-Inorganic Perovskites: From Basics to Devices

Scaling law for excitons in 2D perovskite quantum wells.

Simultaneous control of emission localization and two-photon absorption efficiency in dissymmetrical chromophores.

Structural Diversity in White-Light-Emitting Hybrid Lead Bromide Perovskites

Structural and thermodynamic limits of layer thickness in 2D halide perovskites

Symmetry-Based Tight Binding Modeling of Halide Perovskite Semiconductors.

The importance of relativistic effects on two-photon absorption spectra in metal halide perovskites

The synthesis and one- and two-photon optical properties of dipolar, quadrupolar and octupolar donor-acceptor molecules containing dimesitylboryl groups

Three-Dimensional Lead Iodide Perovskitoid Hybrids with High X-ray Photoresponse

Tunable White-Light Emission in Single-Cation-Templated Three-Layered 2D Perovskites (CH3CH2NH3)4Pb3Br10-xClx

Tuning Electronic Structure in Layered Hybrid Perovskites with Organic Spacer Substitution

Two-Dimensional Dion-Jacobson Hybrid Lead Iodide Perovskites with Aromatic Diammonium Cations

Two-Dimensional Halide Perovskites Incorporating Straight Chain Symmetric Diammonium Ions, (NH3CmH2mNH3)(CH3NH3)n−1PbnI3n+1 (m = 4–9; n = 1–4)

Two-photon transitions in quadrupolar and branched chromophores: experiment and theory

Understanding quantum confinement of charge carriers in layered 2D hybrid perovskites

Vibronic coupling to simulate the phosphorescence spectra of Ir(III)-based OLED systems: TD-DFT results meet experimental data.