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Graphitic Nitrogen Triggers Red Fluorescence in Carbon Dots

ACS nano, 2017-12, Vol.11 (12), p.12402-12410

2017

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Multireference Approaches for Excited States of Molecules

Chemical reviews, 2018-08, Vol.118 (15), p.7293-7361

2018

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Mechanisms of Orthogonal Photodecarbonylation Reactions of 3‑Hydroxyflavone-Based Acid–Base Forms

Journal of organic chemistry, 2020-03, Vol.85 (5), p.3527-3537

2020

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On-Surface Strain-Driven Synthesis of Nonalternant Non-Benzenoid Aromatic Compounds Containing Four- to Eight-Membered Rings

Journal of the American Chemical Society, 2021-09, Vol.143 (36), p.14694-14702

2021

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On-Surface Hydrogenation of Buckybowls: From Curved Aromatic Molecules to Planar Non-Kekulé Aromatic Hydrocarbons

ACS nano, 2020-12, Vol.14 (12), p.16735-16742

2020

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Mechano-Optical Switching of a Single Molecule with Doublet Emission

ACS nano, 2020-07, Vol.14 (7), p.8931-8938

2020

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Conformational Behavior and Optical Properties of a Fluorophore Dimer as a Model of Luminescent Centers in Carbon Dots

Journal of physical chemistry. C, 2020-07, Vol.124 (26), p.14327-14337

2020

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Doping Capabilities of Fluorine on the UV Absorption and Emission Spectra of Pyrene-Based Graphene Quantum Dots

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-12, Vol.124 (52), p.10954-10966

2020

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Spin Crossover in Iron(II) Porphyrazine Induced by Noncovalent Interactions Combined with Hybridization of Iron(II) Porphyrazine and Ligand’s Orbitals: CASPT2, CCSD(T), and DFT Studies

Journal of physical chemistry. C, 2019-09, Vol.123 (37), p.23186-23194

2019

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Diradical Organic One‐Dimensional Polymers Synthesized on a Metallic Surface

Angewandte Chemie (International ed.), 2020-09, Vol.59 (40), p.17594-17599

International ed. in English, 2020

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Nonadiabatic Dynamics of Uracil: Population Split among Different Decay Mechanisms

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-06, Vol.115 (21), p.5247-5255

2011

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Spectroscopic Properties of Naphthalene on the Surface of Ice Grains Revisited: A Combined Experimental–Computational Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-08, Vol.119 (32), p.8565-8578

2015

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Addition Reaction between Piperidine and C60 to Form 1,4-Disubstituted C60 Proceeds through van der Waals and Dative Bond Complexes: Theoretical and Experimental Study

Journal of the American Chemical Society, 2021-07, Vol.143 (29), p.10930-10939

2021

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Emission Energies and Stokes Shifts for Single Polycyclic Aromatic Hydrocarbon Sheets in Comparison to the Effect of Excimer Formation

The journal of physical chemistry letters, 2019-09, Vol.10 (18), p.5592-5597

2019

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Photochemistry of 4‑Chlorophenol in Liquid and Frozen Aqueous Media Studied by Chemical, Compound-Specific Isotope, and DFT Analyses

Langmuir, 2015-10, Vol.31 (39), p.10743-10750

2015

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Clustering of Uracil Molecules on Ice Nanoparticles

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2017-02, Vol.121 (5), p.1069-1077

2017

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Biomolecule Analogues 2‑Hydroxypyridine and 2‑Pyridone Base Pairing on Ice Nanoparticles

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2016-07, Vol.120 (27), p.4720-4730

2016

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Does Stacking Restrain the Photodynamics of Individual Nucleobases?

Journal of the American Chemical Society, 2010-06, Vol.132 (24), p.8261-8263

2010

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Spectroscopic Properties of Anisole at the Air–Ice Interface: A Combined Experimental–Computational Approach

Langmuir, 2016-06, Vol.32 (23), p.5755-5764

2016

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Photodynamics Simulations of Thymine: Relaxation into the First Excited Singlet State

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2009-11, Vol.113 (45), p.12686-12693

2009

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Spectroscopic Properties of Benzene at the Air–Ice Interface: A Combined Experimental–Computational Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-09, Vol.118 (35), p.7535-7547

2014

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Unexpected Photoreactivity in a NO2‑Functionalized Aluminum-MOF

Journal of physical chemistry. C, 2015-11, Vol.119 (47), p.26401-26408

2015

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Self-Organization of 1-Methylnaphthalene on the Surface of Artificial Snow Grains: A Combined Experimental–Computational Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-10, Vol.115 (41), p.11412-11422

2011

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The stability of covalent dative bond significantly increases with increasing solvent polarity

Nature communications, 2022-04, Vol.13 (1), p.2107-2107, Article 2107

2022

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Graphitic Nitrogen Triggers Red Fluorescence in Carbon Dots

Multireference Approaches for Excited States of Molecules

Mechanisms of Orthogonal Photodecarbonylation Reactions of 3‑Hydroxyflavone-Based Acid–Base Forms

On-Surface Strain-Driven Synthesis of Nonalternant Non-Benzenoid Aromatic Compounds Containing Four- to Eight-Membered Rings

On-Surface Hydrogenation of Buckybowls: From Curved Aromatic Molecules to Planar Non-Kekulé Aromatic Hydrocarbons

Mechano-Optical Switching of a Single Molecule with Doublet Emission

Conformational Behavior and Optical Properties of a Fluorophore Dimer as a Model of Luminescent Centers in Carbon Dots

Doping Capabilities of Fluorine on the UV Absorption and Emission Spectra of Pyrene-Based Graphene Quantum Dots

Spin Crossover in Iron(II) Porphyrazine Induced by Noncovalent Interactions Combined with Hybridization of Iron(II) Porphyrazine and Ligand’s Orbitals: CASPT2, CCSD(T), and DFT Studies

Diradical Organic One‐Dimensional Polymers Synthesized on a Metallic Surface

Nonadiabatic Dynamics of Uracil: Population Split among Different Decay Mechanisms

Spectroscopic Properties of Naphthalene on the Surface of Ice Grains Revisited: A Combined Experimental–Computational Approach

Addition Reaction between Piperidine and C60 to Form 1,4-Disubstituted C60 Proceeds through van der Waals and Dative Bond Complexes: Theoretical and Experimental Study

Emission Energies and Stokes Shifts for Single Polycyclic Aromatic Hydrocarbon Sheets in Comparison to the Effect of Excimer Formation

Photochemistry of 4‑Chlorophenol in Liquid and Frozen Aqueous Media Studied by Chemical, Compound-Specific Isotope, and DFT Analyses

Clustering of Uracil Molecules on Ice Nanoparticles

Biomolecule Analogues 2‑Hydroxypyridine and 2‑Pyridone Base Pairing on Ice Nanoparticles

Does Stacking Restrain the Photodynamics of Individual Nucleobases?

Spectroscopic Properties of Anisole at the Air–Ice Interface: A Combined Experimental–Computational Approach

Photodynamics Simulations of Thymine: Relaxation into the First Excited Singlet State

Spectroscopic Properties of Benzene at the Air–Ice Interface: A Combined Experimental–Computational Approach

Unexpected Photoreactivity in a NO2‑Functionalized Aluminum-MOF

The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry

Self-Organization of 1-Methylnaphthalene on the Surface of Artificial Snow Grains: A Combined Experimental–Computational Approach

The stability of covalent dative bond significantly increases with increasing solvent polarity

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