Lista de obras - Mihajlo Etinski - Dominio Público Uruguay

A Theoretical Investigation of the Geometries and Binding Energies of Molecular Tweezer and Clip Host-Guest Systems

artículo científico publicado en 2005

A new insight into the photochemistry of avobenzone in gas phase and acetonitrile from ab initio calculations

artículo científico publicado en 2016

A theoretical study of low-lying singlet and triplet excited states of quinazoline, quinoxaline and phthalazine: insight into triplet formation

artículo científico publicado en 2017

Ab initio investigation of the methylation and hydration effects on the electronic spectra of uracil and thymine

artículo científico publicado en 2010

Counterdiabatic suppression of background state population in resonance leaking by controlling intermediate branching

artículo científico publicado en 2006

Electronic and vibrational spectroscopy of 1-methylthymine and its water clusters: the dark state survives hydration.

artículo científico publicado en 2008

Electron–Vibrational Coupling and Fluorescence Spectra of Tetra-, Penta-, and Hexacoordinated Chlorophylls c1 and c2

artículo científico publicado en 2015

Elucidating Solvent Effects on Strong Intramolecular Hydrogen Bond: DFT-MD Study of Dibenzoylmethane in Methanol Solution

artículo científico publicado en 2019

Exciton energy transfer in organic light emitting diodes with thermally activated delayed fluorescence dopants

In search of the dark state of 5-methyl-2-hydroxypyrimidine using a numerical DFT/MRCI gradient

Influence of the electron donor properties of hypericin on its sensitizing ability in DSSCs

artículo científico publicado en 2019

Intersystem crossing and characterization of dark states in the pyrimidine nucleobases uracil, thymine, and 1-methylthymine

artículo científico publicado en 2009

Intersystem crossing rates of S1 state keto-amino cytosine at low excess energy

artículo científico publicado en 2015

Intriguing Intermolecular Interplay in Guanine Quartet Complexes with Alkali and Alkaline Earth Cations

artículo científico publicado en 2020

New Insight into Uracil Stacking in Water from ab Initio Molecular Dynamics

artículo científico publicado en 2018

Overruling the energy gap law: fast triplet formation in 6-azauracil ⬇️

artículo científico publicado el 3 de agosto de 2010

Photophysics of Xanthone: A Quantum Chemical Perusal

artículo científico publicado en 2013

Pulse-train control of branching processes: elimination of background and intruder state population

artículo científico publicado en 2008

Puzzle of the Intramolecular Hydrogen Bond of Dibenzoylmethane Resolved by Molecular Dynamics Simulations

artículo científico publicado en 2018

Reverse intersystem crossing in rhodamines by near-infrared laser excitation

artículo científico publicado en 2014

Stability and Anharmonic N-H Stretching Frequencies of 1-Methylthymine Dimers: Hydrogen Bonding versus π-Stacking

artículo científico publicado en 2016

The UVA response of enolic dibenzoylmethane: beyond the static approach

scientific article published on 01 June 2019

The significance of the metal cation in guanine-quartet - metalloporphyrin complexes

artículo científico publicado en 2020

Theoretical investigation of the excited states of 2-nitrobenzyl and 4,5-methylendioxy-2-nitrobenzyl caging groups.

artículo científico publicado en 2009

Thermal and solvent effects on the triplet formation in cinnoline

artículo científico publicado en 2014

Time-dependent approach to spin-vibronic coupling: implementation and assessment

artículo científico publicado en 2014

Time-dependent approaches for the calculation of intersystem crossing rates

artículo científico publicado en 2011

Ultrafast deactivation mechanism of the excited singlet in the light-induced spin crossover of [Fe(2,2'-bipyridine)3]2+.

artículo científico publicado en 2013

Unraveling the mechanism of biomimetic hydrogen fuel production - a first principles molecular dynamics study

scientific article published on 18 March 2020

Using Density Functional Theory To Study Neutral and Ionized Stacked Thymine Dimers

artículo científico publicado en 2016

Lista de obras de Mihajlo Etinski

A Theoretical Investigation of the Geometries and Binding Energies of Molecular Tweezer and Clip Host-Guest Systems

A new insight into the photochemistry of avobenzone in gas phase and acetonitrile from ab initio calculations

A theoretical study of low-lying singlet and triplet excited states of quinazoline, quinoxaline and phthalazine: insight into triplet formation

Ab initio investigation of the methylation and hydration effects on the electronic spectra of uracil and thymine

Counterdiabatic suppression of background state population in resonance leaking by controlling intermediate branching

Electronic and vibrational spectroscopy of 1-methylthymine and its water clusters: the dark state survives hydration.

Electron–Vibrational Coupling and Fluorescence Spectra of Tetra-, Penta-, and Hexacoordinated Chlorophylls c1 and c2

Elucidating Solvent Effects on Strong Intramolecular Hydrogen Bond: DFT-MD Study of Dibenzoylmethane in Methanol Solution

Exciton energy transfer in organic light emitting diodes with thermally activated delayed fluorescence dopants

In search of the dark state of 5-methyl-2-hydroxypyrimidine using a numerical DFT/MRCI gradient

Influence of the electron donor properties of hypericin on its sensitizing ability in DSSCs

Intersystem crossing and characterization of dark states in the pyrimidine nucleobases uracil, thymine, and 1-methylthymine

Intersystem crossing rates of S1 state keto-amino cytosine at low excess energy

Intriguing Intermolecular Interplay in Guanine Quartet Complexes with Alkali and Alkaline Earth Cations

New Insight into Uracil Stacking in Water from ab Initio Molecular Dynamics

Overruling the energy gap law: fast triplet formation in 6-azauracil ⬇️

Photophysics of Xanthone: A Quantum Chemical Perusal

Pulse-train control of branching processes: elimination of background and intruder state population

Puzzle of the Intramolecular Hydrogen Bond of Dibenzoylmethane Resolved by Molecular Dynamics Simulations

Reverse intersystem crossing in rhodamines by near-infrared laser excitation

Stability and Anharmonic N-H Stretching Frequencies of 1-Methylthymine Dimers: Hydrogen Bonding versus π-Stacking

The UVA response of enolic dibenzoylmethane: beyond the static approach

The significance of the metal cation in guanine-quartet - metalloporphyrin complexes

Theoretical investigation of the excited states of 2-nitrobenzyl and 4,5-methylendioxy-2-nitrobenzyl caging groups.

Thermal and solvent effects on the triplet formation in cinnoline

Time-dependent approach to spin-vibronic coupling: implementation and assessment

Time-dependent approaches for the calculation of intersystem crossing rates

Ultrafast deactivation mechanism of the excited singlet in the light-induced spin crossover of [Fe(2,2'-bipyridine)3]2+.

Unraveling the mechanism of biomimetic hydrogen fuel production - a first principles molecular dynamics study

Using Density Functional Theory To Study Neutral and Ionized Stacked Thymine Dimers