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1

Protonated salicylaldehyde: Electronic properties

Ivan Alata, Reza Omidyan, Michel Broquier, Claude Dedonder, Christophe Jouvet

Journal:

Chemical Physics

Year:

2012

Language:

english

File:

PDF, 613 KB

english, 2012

2

Protonation effect on the electronic structure of small PAHs: Acenaphthylene and Acenaphthene

Journal:

Chemical Physics Letters

Year:

2011

Language:

english

File:

PDF, 421 KB

english, 2011

3

Substitution effects on the UV–vis and 1H NMR spectra of the dications of meso and/or β substituted porphyrins with trifluoroacetic acid: Electron-deficient porphyrins compared to the electron-rich ones

Saeed Zakavi, Reza Omidyan, Leila Ebrahimi, Fatemeh Heidarizadi

Journal:

Inorganic Chemistry Communications

Year:

2011

Language:

english

File:

PDF, 339 KB

english, 2011

4

Porphine core saddling: Effects on the HOMO/LUMO gap and the macrocycle bond lengths and bond angles

Saeed Zakavi, Reza Omidyan, Sadegh Talebzadeh

Journal:

Year:

2013

Language:

english

File:

PDF, 300 KB

english, 2013

5

Theoretical Investigation of Excited State Proton Transfer Process in the N -Salicylidene-2-bromoethylamine

Moghadam, Ahmad J., Omidyan, Reza, Mirkhani, Valiollah, Azimi, Gholamhasan

Journal:

Journal of Physical Chemistry A

Year:

2013

Language:

english

File:

PDF, 352 KB

english, 2013

6

Electronically excited states of protonated phenol and para-substituted phenol

Azizkarimi, Shirin, Omidyan, Reza, Azimi, Gholamhasan

Journal:

Chemical Physics Letters

Year:

2013

Language:

english

File:

PDF, 393 KB

english, 2013

7

Protonation effect on the electronic properties of 2-pyridone monomer, dimer and its water clusters: A theoretical study

Saed, Behnaz, Omidyan, Reza

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.57 MB

english, 2014

8

Microhydration Effects on the Electronic Properties of Protonated Phenol: A Theoretical Study

Ataelahi, Mitra, Omidyan, Reza

Journal:

Journal of Physical Chemistry A

Year:

2013

Language:

english

File:

PDF, 1.59 MB

english, 2013

9

Hydrogen bond strengthening of cis–trans glyoxal dimers in electronic excited states: A theoretical study

Poorabdollah, Hamidreza, Omidyan, Reza, Solimannejad, Mohammad, Azimi, Gholamhasan

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2014

Language:

english

File:

PDF, 646 KB

english, 2014

10

Protonated Benzene Dimer: An Experimental and Ab Initio Study

Chakraborty, Shamik, Omidyan, Reza, Alata, Ivan, Nielsen, Iben B., Dedonder, Claude, Broquier, Michel, Jouvet, Christophe

Journal:

Journal of the American Chemical Society

Year:

2009

Language:

english

File:

PDF, 1.36 MB

english, 2009

11

Excited state deactivation pathways of neutral/protonated anisole and p-fluoroanisole: a theoretical study

Omidyan, Reza, Rezaei, Hajar

Journal:

Physical Chemistry Chemical Physics

Year:

2014

Language:

english

File:

PDF, 2.23 MB

english, 2014

12

Electronically Excited States of Protonated Aromatic Hydrocarbons: Phenanthrene and Pyrene

Saed, Behnaz, Omidyan, Reza

Journal:

Journal of Physical Chemistry A

Year:

2013

Language:

english

File:

PDF, 1.76 MB

english, 2013

13

Effect of protonation on the electronic structure of aromatic molecules: naphthaleneH+

Alata, Ivan, Omidyan, Reza, Broquier, Michel, Dedonder, Claude, Dopfer, Otto, Jouvet, Christophe

Journal:

Physical Chemistry Chemical Physics

Year:

2010

Language:

english

File:

PDF, 1.04 MB

english, 2010

14

Electronic and vibrational spectra of protonated benzaldehyde-water clusters, [BZ-(H2O)n≤5]H+: Evidence for ground-state proton transfer to solvent for n ≥ 3

Dopfer, Otto, Patzer, Alexander, Chakraborty, Shamik, Alata, Ivan, Omidyan, Reza, Broquier, Michel, Dedonder, Claude, Jouvet, Christophe

Journal:

The Journal of Chemical Physics

Year:

2014

Language:

english

File:

PDF, 1.83 MB

english, 2014

15

Photophysics and photochemistry of cis- and trans-hydroquinone, catechol and their ammonia clusters: a theoretical study

Ataelahi, Mitra, Omidyan, Reza, Azimi, Gholamhassan

Journal:

Photochemical & Photobiological Sciences

Year:

2015

Language:

english

File:

PDF, 1.75 MB

english, 2015

16

Excited-state deactivation mechanisms of protonated and neutral phenylalanine: a theoretical study

Omidyan, Reza, Ataelahi, Mitra, Azimi, Gholamhassan

Journal:

Year:

2015

Language:

english

File:

PDF, 1.17 MB

english, 2015

17

Electronically Excited States of Neutral, Protonated α-Naphthol and Their Water Clusters: A Theoretical Study

Omidyan, Reza, Heidari, Zahra, Salehi, Mohammad, Azimi, Gholamhassan

Journal:

Journal of Physical Chemistry A

Year:

2015

Language:

english

File:

PDF, 1.44 MB

english, 2015

18

A Theoretical Exploration on Electronically Excited States of Protonated Furan and Thiophene

Omidyan, Reza, Salehi, Mohammad, Heidari, Zahra

Journal:

Photochemical & Photobiological Sciences

Year:

2015

Language:

english

File:

PDF, 933 KB

english, 2015

19

A theoretical exploration on the nonradiative deactivation of hydrogen-bond complexes: isoindole-pyridine and quinoline-pyrrole

Omidyan, Reza, Salehi, Mohammad, Azimi, Gholamhassan

Journal:

Year:

2015

Language:

english

File:

PDF, 1.44 MB

english, 2015

20

Excited State Proton Transfer and Deactivation Mechanism of 2‑(4′-Amino-2′-hydroxyphenyl)‑1H‑imidazo-[4,5‑c]pyridine and its Analogues: A theoretical study

Omidyan, Reza, Iravani, Maryam

Journal:

Journal of Physical Chemistry A

Year:

2016

Language:

english

File:

PDF, 868 KB

english, 2016

21

Electronically excited state of neutral/protonated, Indole/5-Hydroxyinodole-water clusters: a theoretical study

Omidyan, Reza, omidyan, Masoud, mohamadzadeh, Atefeh

Journal:

Year:

2016

Language:

english

File:

PDF, 1.31 MB

english, 2016

22

The influence of protonation on the structure and spectral properties of porphine: UV-vis, 1H NMR and ab initio studies

Zakavi, Saeed, Omidyan, Reza, Talebzadeh, Sadegh

Journal:

Year:

2016

Language:

english

File:

PDF, 1.07 MB

english, 2016

23

Excited-state intramolecular proton transfer and photoswitching in hydroxyphenyl-imidazopyridine derivatives: A theoretical study

Omidyan, Reza, Iravani, Maryam

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 2.04 MB

english, 2016

24

Protonated serotonin: Geometry, electronic structures and photophysical properties

Omidyan, Reza, Amanollahi, Zohreh, Azimi, Gholamhassan

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2017

Language:

english

File:

PDF, 1.91 MB

english, 2017

25

Solvation effect on isomer stability and electronic structures of protonated serotonin

Omidyan, Reza, Amanollahi, Zohreh, Azimi, Gholamhassan

Journal:

Chemical Physics Letters

Year:

2017

Language:

english

File:

PDF, 439 KB

english, 2017

26

Excited-State Proton Transfer in Thiazolo-[4, 5-d]Thiazo Heterocyclic Systems and the Geometry Alterations’ Effect on Photophysical Characters: A Theoretical Study

Abedini, Fatemeh, Omidyan, Reza

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 2.03 MB

english, 2018

27

Photochromism of 2-(2-Hydroxyphenyl) Benzothiazole (HBT) and Its Derivatives; A Theoretical Study

Iravani, Maryam, Omidyan, Reza

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 1.70 MB

english, 2018

28

Optical properties of β-brominated meso -tetraphenylporphyrins: Comparative experimental and computational studies

Alghooneh, Leila, Eskandari, Mortaza, Zakavi, Saeed, Omidyan, Reza

Journal:

Journal of Porphyrins and Phthalocyanines

Year:

2018

Language:

english

File:

PDF, 1.28 MB

english, 2018

29

Photophysical and optoelectronic properties of a platinum(II) complex and its derivatives, designed as a highly efficient OLED emitter: A theoretical study

Omidyan, Reza, Abbasi, Maryam, Azimi, Gholamhassan

Journal:

International Journal of Quantum Chemistry

Year:

2018

Language:

english

File:

PDF, 1.71 MB

english, 2018

30

Photophysics of Protonated and Microhydrated 2-Aminobenzaldehyde: Theoretical Insights into Photoswitchability of Protonated Systems

Salehi, Mohammad, Heidari, Zahra, Omidyan, Reza

Journal:

Journal of Physical Chemistry A

Year:

2018

Language:

english

File:

PDF, 1.37 MB

english, 2018

31

The dramatic effect of N -methylimidazole on trans axial ligand binding to ferric heme: experiment and theory

Aarabi, Mohammad, Omidyan, Reza, Soorkia, Satchin, Grégoire, Gilles, Broquier, Michel, Crestoni, Maria-Elisa, de la Lande, Aurélien, Soep, Benoît, Shafizadeh, Niloufar

Journal:

Physical Chemistry Chemical Physics

Year:

2019

Language:

english

File:

PDF, 2.73 MB

english, 2019

32

Water binding to Fe III Hemes studied in a cooled ion trap, characterization of a strong ‘weak’ ligand

Aarabi, Mohammad, Soorkia, Satchin, Gregoire, Gilles, Broquier, Michel, de la Lande, Aurélien, Soep, Benoît, Omidyan, Reza, Shafizadeh, Niloufar

Journal:

Physical Chemistry Chemical Physics

Year:

2019

Language:

english

File:

PDF, 1.90 MB

english, 2019

33

Theoretical insights on nonradiative deactivation mechanisms of protonated xanthine

Abedini, Fatemeh, Omidyan, Reza, Salehi, Mohammad

Journal:

Journal of Photochemistry and Photobiology A: Chemistry

Year:

2019

Language:

english

File:

PDF, 2.89 MB

english, 2019

34

Theoretical insights on nonradiative deactivation mechanisms of protonated xanthine

Abedini, Fatemeh, Omidyan, Reza, Salehi, Mohammad

Journal:

Journal of Photochemistry and Photobiology A: Chemistry

Year:

2019

File:

PDF, 2.89 MB

2019

35

Excited State Deactivation Mechanism in Protonated Uracil: New Insights from Theoretical Studies

Omidyan, Reza, Abedini, Fatemeh, Shahrokh, Leila, Azimi, Gholamhassan

Journal:

Journal of Physical Chemistry A

Year:

2020

File:

PDF, 1.08 MB

2020

36

DFT study of Î±-Keggin, lacunary Keggin, and iron IIâVI substituted Keggin polyoxometalates: the effect of oxidation state and axial ligand on geometry, electronic structures and oxygen transfer

Mir, Soheila, Yadollahi, Bahram, Omidyan, Reza, Azimi, Gholamhasan

Journal:

Year:

2020

File:

PDF, 1.08 MB

2020

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