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Aggregation-caused quenching versus crystallization induced emission in thiazolo[5,4-b]thieno[3,2-e]pyridine (TTP) derivatives: theoretical insights

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (1), p.46-56

2019

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Computational prediction of the supramolecular self-assembling properties of organic molecules: the role of conformational flexibility of amide moieties

Physical chemistry chemical physics : PCCP, 2021-09, Vol.23 (36), p.2453-2465

2021

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Synthesis of 1,6/7‐(NO2)2‐Perylenediimide and 1,6/7‐(NH2)2‐Perylenediimide as Regioisomerically Pure Materials

Chemistry : a European journal, 2023-06, Vol.29 (33), p.e202300652-n/a

2023

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Modeling the Modulation of Emission Behavior in E/Z Isomers of Dipyrrolyldiphenylethene: From Molecules to Nanoaggregates

Journal of physical chemistry. C, 2017-11, Vol.121 (45), p.25603-25616

2017

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Second Harmonic Generation Signatures of Supramolecular Assemblies Based on Amide Moieties

Chemphyschem, 2023-07, Vol.24 (13), p.e202300150-n/a

2023

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Modeling Photonastic Materials: A First Computational Study

Journal of chemical theory and computation, 2020-11, Vol.16 (11), p.7017-7032

2020

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Understanding the properties of dithienylethenes functionalized for supramolecular self-assembly: a molecular modeling study

Physical chemistry chemical physics : PCCP, 2020-04, Vol.22 (13), p.6942-6952

2020

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Aggregation‐Induced Emission: A Challenge for Computational Chemistry Taking TPA‐BMO as an Example

Chemphyschem, 2021-09, Vol.22 (17), p.1802-1816

2021

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Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

Angewandte Chemie International Edition, 2022-10, Vol.61 (40), p.e202208679-n/a

International ed. in English, 2022

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In Silico Investigation of the Aggregation‐Caused Quenching: the “Tolane‐Based Molecule” Case

ChemPhotoChem, 2019-09, Vol.3 (9), p.794-803

2019

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ortho O -Annulated azabenzannulated perylenediimide and bisazacoronenediimide

Journal of materials chemistry. C, Materials for optical and electronic devices, 2023-11, Vol.11 (42), p.14631-14640

2023

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Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

Angewandte Chemie, 2022-10, Vol.134 (40), p.n/a

2022

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Cover Feature: Second Harmonic Generation Signatures of Supramolecular Assemblies Based on Amide Moieties (ChemPhysChem 13/2023)

Chemphyschem, 2023-07, Vol.24 (13), p.n/a

2023

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Intermolecular Anionic Mixed-Valence and π-Dimer Complexes of Ortho-Pentannulated BisAzaCoroneneDiimides

Angewandte Chemie International Edition, 2024-08, p.e202413616

2024

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In silico investigation of the interaction between α-synuclein aggregates and organic supramolecular assemblies

Molecular systems design & engineering, 2024-08

2024

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Thermally Controlled Exciplex Fluorescence in a Dynamic Homo[2]catenane

Journal of the American Chemical Society, 2022-12, Vol.144 (51), p.23551-23559

2022

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Mechanical Effect Produced by Photo‐Switchable Reactions: Insights from Molecular Simulations

Macromolecular theory and simulations, 2024-07

2024

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Aggregation-caused quenching versus crystallization induced emission in thiazolo[5,4-b]thieno[3,2-e]pyridine (TTP) derivatives: theoretical insightsElectronic supplementary information (ESI) available: Choice of the XC functional, selected molecular orbitals; frequencies and HR factors; packing structures in single crystals. See DOI: 10.1039/c8cp04730h

2018-12

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Bigger is not Better for Indolino‐Oxazoline Photochemical Properties

ChemPhotoChem, 2024-07, Vol.8 (7), p.n/a

2024

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Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

Angewandte Chemie International Edition, 2022-08, Vol.61 (40)

2022

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Annulated azabenzannulated perylenediimide and bisazacoronenediimide

Journal of materials chemistry. C, Materials for optical and electronic devices, 2023-11, Vol.11 (42), p.14631-1464

2023

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The role of the [CpM(CO)2]− chromophore in the optical properties of the [Cp2ThMCp(CO)2]+ complexes, where M = Fe, Ru and OsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5dt03121d. A theoretical view

2015-11

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The role of the [CpM(CO)2](-) chromophore in the optical properties of the [Cp2ThMCp(CO)2](+) complexes, where M = Fe, Ru and Os. A theoretical view

Dalton transactions : an international journal of inorganic chemistry, 2015-01, Vol.44 (46), p.20004-20010

2015

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The role of the [CpM(CO) sub(2)] super(-) chromophore in the optical properties of the [Cp sub(2)ThMCp(CO) sub(2)] super(+) complexes, where M = Fe, Ru and Os . A theoretical view

Dalton transactions : an international journal of inorganic chemistry, 2015-11, Vol.44 (46), p.20004-20010

2015

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Atlantic Meridional Overturning Circulation: Observed Transport and Variability

Frontiers in Marine Science, 2019-06, Vol.6

2019

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Aggregation-caused quenching versus crystallization induced emission in thiazolo[5,4-b]thieno[3,2-e]pyridine (TTP) derivatives: theoretical insights

Computational prediction of the supramolecular self-assembling properties of organic molecules: the role of conformational flexibility of amide moieties

Synthesis of 1,6/7‐(NO2)2‐Perylenediimide and 1,6/7‐(NH2)2‐Perylenediimide as Regioisomerically Pure Materials

Modeling the Modulation of Emission Behavior in E/Z Isomers of Dipyrrolyldiphenylethene: From Molecules to Nanoaggregates

Second Harmonic Generation Signatures of Supramolecular Assemblies Based on Amide Moieties

Modeling Photonastic Materials: A First Computational Study

Understanding the properties of dithienylethenes functionalized for supramolecular self-assembly: a molecular modeling study

Aggregation‐Induced Emission: A Challenge for Computational Chemistry Taking TPA‐BMO as an Example

Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

In Silico Investigation of the Aggregation‐Caused Quenching: the “Tolane‐Based Molecule” Case

ortho O -Annulated azabenzannulated perylenediimide and bisazacoronenediimide

Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

Cover Feature: Second Harmonic Generation Signatures of Supramolecular Assemblies Based on Amide Moieties (ChemPhysChem 13/2023)

Intermolecular Anionic Mixed-Valence and π-Dimer Complexes of Ortho-Pentannulated BisAzaCoroneneDiimides

In silico investigation of the interaction between α-synuclein aggregates and organic supramolecular assemblies

Thermally Controlled Exciplex Fluorescence in a Dynamic Homo[2]catenane

Mechanical Effect Produced by Photo‐Switchable Reactions: Insights from Molecular Simulations

Bigger is not Better for Indolino‐Oxazoline Photochemical Properties

Aggregation‐Induced Emission and Circularly Polarized Luminescence Duality in Tetracationic Binaphthyl‐Based Cyclophanes

Annulated azabenzannulated perylenediimide and bisazacoronenediimide

The role of the [CpM(CO)2]− chromophore in the optical properties of the [Cp2ThMCp(CO)2]+ complexes, where M = Fe, Ru and OsElectronic supplementary information (ESI) available. See DOI: 10.1039/c5dt03121d. A theoretical view

The role of the [CpM(CO)2](-) chromophore in the optical properties of the [Cp2ThMCp(CO)2](+) complexes, where M = Fe, Ru and Os. A theoretical view

The role of the [CpM(CO) sub(2)] super(-) chromophore in the optical properties of the [Cp sub(2)ThMCp(CO) sub(2)] super(+) complexes, where M = Fe, Ru and Os . A theoretical view

Atlantic Meridional Overturning Circulation: Observed Transport and Variability

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