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Publications by Mario Barbatti

Recent Advances and Perspectives on Nonadiabatic Mixed Quantum–Classical Dynamics

Chemical Reviews
Chemistry
2018English

Photochemistry of CH3Cl: Dissociation and CH···Cl Hydrogen Bond Formation

Journal of the American Chemical Society
BiochemistryColloidCatalysisChemistrySurface Chemistry
2015English

Promoting Intersystem Crossing of Fluorescent Molecule via Single Functional Group Modification

Journal of Physical Chemistry Letters
Materials ScienceNanotechnologyPhysicalTheoretical ChemistryNanoscience
2019English

Evaluation of Spin-Orbit Couplings With Linear-Response Time-Dependent Density Functional Methods

Journal of Chemical Theory and Computation
Theoretical ChemistryComputer Science ApplicationsPhysical
2017English

Computational Reference Data for the Photochemistry of Cyclobutane Pyrimidine Dimers

ChemPhysChem
Theoretical ChemistryPhysicalOpticsAtomicMolecular Physics,
2014English

Intersystem Crossing Dynamics in Singly Substituted Thiouracil Studied by Time-Resolved Photoelectron Spectroscopy: Micro-Environmental Effects Due to Sulfur Position

Chemical Physics
Theoretical ChemistryAstronomyPhysicsPhysical
2018English

New Insights Into the State Trapping of UV-Excited Thymine

2016English

Automerization Reaction of Cyclobutadiene and Its Barrier Height: Anab Initiobenchmark Multireference Average-Quadratic Coupled Cluster Study

Journal of Chemical Physics
MedicineTheoretical ChemistryAstronomyPhysicsPhysical
2006English

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