علیرضا شایسته

1. Ab initio potential energy curves and transition dipole moments for the low-lying electronic states of InAg

Sharifi Hossein، Shayesteh Alireza (2025)., CHEMICAL PHYSICS LETTERS, 862(1), 141866.

2. Theoretical study of vibronic absorption spectra and Franck-Condon factors of copper and silver hydrides

Mohammadian Zeinab، Maghari Ali، Shayesteh Alireza (2024)., CHEMICAL PHYSICS, 586(7), 112375.

3. Spin-orbit coupling in excited electronic states of AgH

Mohammadian Zeinab، Nouri Gheimasi Farnoush، Maghari Ali، Shayesteh Alireza (2024)., CHEMICAL PHYSICS LETTERS, 849(7), 141418.

4. Multireference Ab Initio Calculations on Excited Electronic States of Carbazole-Based Organic Compounds for Thermally Activated Delayed Fluorescence

Mohammadian Sabet Fariba Sadat، Shayesteh Alireza (2024)., JOURNAL OF PHYSICAL CHEMISTRY A, 128(25), 4937-4949.

1. Carboxamide Fe(III) complex as the electrocatalyst of water oxidation reaction: WNA and I2M O–O bond formation pathways

Binaeizadeh Mohammad Reza، Amiri Ahmad، Shayesteh Alireza، Fadaei Farzaneh (2024)., INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 51(1), 709-721.

2. Spin–orbit coupling in low-lying electronic states of CuH

Mohammadian Zeinab، Shayesteh Alireza (2023)., PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 25(44), 30488-30500.

1. Two new metal-organic frameworks: Synthesis, characterization, gas adsorption and simulation

Safarkoopayeh Barzin، Abbasi Ali Reza، Shayesteh Alireza (2021)., INORGANIC CHEMISTRY COMMUNICATIONS, 127(1), 108502.

2. How does counter-cation substitution influence inter- and intramolecular hydrogen bonding and electrospinnability of alginates

Asadi-Korayem Maryam، Akbari-Taemeh Mahdokht، Mohammadian Sabet Fariba Sadat، Shayesteh Alireza، Daemi Hamed (2021)., International Journal of Biological Macromolecules, 171(1), 234-241.

3. Time-Dependent Density Functional Theory

Shayesteh Alireza (2020)., 9th Theoretical and Computational Chemistry Workshop, 8-16 December, Tehran, Iran.

4. Dual mode colorimetric-fluorescent sensor for highly sensitive and selective detection of Mg2+ ion in aqueous media

Majidi Behnam، Amiri Ahmad، Badiei Ali Reza، Shayesteh Alireza (2020)., JOURNAL OF MOLECULAR STRUCTURE, 1213(1), 128156.

5. Ab Initio Calculations on Sequential Reactions of Nitric Oxide with Titanium Ions in the Gas Phase

[] []، Shayesteh Alireza (2020)., JOURNAL OF PHYSICAL CHEMISTRY A, 124(25), 5194-5203.

1. Fluorene-Functionalized, Dendrimer-Modified SBA-15: Detection of Iron(III) and Mercury (II) in Aqueous Media and Logic Gate Studies

Jafari Maryam، Amiri Ahmad، Badiei Ali Reza، Shayesteh Alireza (2019)., ChemistrySelect, 4(1), 12559.

2. A 3D Polyoxoniobate-based Framework Showing Performance in Dye Removal from Aqueous Solution

Safarkoopayeh Barzin، Abbasi Ali Reza، Mokarizadeh Abdol Hadi، Shayesteh Alireza، Najafi Mahnaz (2019)., Scientia Iranica, 0(0), 0-0.

3. Spin-Orbit Coupling Matrix Elements in Electronic States of PdH

Shayesteh Alireza، Nabi Fathola A. (2019)., 22nd Iranian Physical Chemistry Conference, 20-22 August, Zanjan, Iran.

4. Rotational and Spin-Orbit Hamiltonian Matrices for Low-Lying States of NiH

Shayesteh Alireza، Nabi Fathola A. (2019)., 22nd Iranian Physical Chemistry Conference, 20-22 August, Zanjan, Iran.

5. Calculation of Electronic Spectra for Carbazole Derivatives for Applications in Thermally Activated Delayed Fluorescence

Mohammadian Sabet Fariba Sadat، Shayesteh Alireza (2019)., 22nd Iranian Physical Chemistry Conference, 20-22 August, Zanjan, Iran.

6. Determination of pK a values for ( E )‐2‐hydroxy‐5‐(aryldiazenyl) benzaldehydes in dimethyl sulfoxide: Cyclic voltammetry and density functional theory calculations

فروزان زنوزی، Shayesteh Alireza، Alizadeh Taher، Dezhampanah Hamid، Ghalami-Choobar Bahram، Zanouzi Afsaneh (2019)., JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 66(7).

7. Ab initio calculations on low‐lying electronic states of PdH

Nabi Fathola A.، Shayesteh Alireza (2019)., INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 119(13), e25967.

1. Ab initio calculations on low-lying electronic states of SiH+

Biglari Zeinab، Shayesteh Alireza، Ershadifar Shokouh (2018)., JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER, 221(1), 80-86.

2. Efficient organic light-emitting diodes from delayed fluorescence

Mohammadian Sabet Fariba Sadat، Shayesteh Alireza (2018)., 21st ICS Physical Chemistry Conference, 6-8 September, Tabriz, Iran.

3. The prediction of absorption and emission wavelengths in thermally activated delayed fluorescence(TADF) organic light-emitting diodes(OLEDs)

Mohammadian Sabet Fariba Sadat، Shayesteh Alireza (2018)., 20th Iranian Chemistry Congress, 17-19 July, Mashhad, Iran.

4. Observation of low-lying electronic states of NiD with multi-isotope analysis

Abbasi Mahdi، Shayesteh Alireza، Crozet Patrick، Ross Amanda (2018)., JOURNAL OF MOLECULAR SPECTROSCOPY, 349(1), 49-59.

5. Fluorescent and colorimetric dual mode probe for detection of iodide through iodide/triiodide equilibrium

Jafari Maryam، Badiei Ali Reza، Shayesteh Alireza، Amiri Ahmad (2018)., JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 364(1), 336-343.

6. Palladium-anchored multidentate SBA-15/di-urea nanoreactor: A highly active catalyst for Suzuki coupling reaction

Rohani Sahar، Mohammadi Ziarani Ghodsi، Badiei Ali Reza، Ziyarati A، Jafari Maryam، Shayesteh Alireza (2018)., APPLIED ORGANOMETALLIC CHEMISTRY, 32(8), e4397.