| High-performance optoelectronic and thermoelectric properties of transparent conductors based on Tl2O3 under pressure HA Rahnamaye Aliabad, A Asadpour Arzefooni, SZ Sadati, EG Özdemir, ... Scientific Reports 14 (1), 9237, 2024 | | 2024 |
| First-principles calculations to investigate thermoelectric efficiency of β-In2S3 under pressure for renewable energy sources HAR Aliabad, Z Choopani, M Azadparvar, H Vaezi Materials Science and Engineering: B 301, 117183, 2024 | | 2024 |
| Electronic structure, optical properties and high thermoelectric figure of merit in iron phthalocyanine polymer: FP-LAPW comparative studies M Bashi, HAR Aliabad Physica B: Condensed Matter 674, 415542, 2024 | | 2024 |
| Effects of applied different potentials on electronic and Half-Metallic characteristics and investigated Pressure-Dependent elastic and thermodynamic properties of VRu2Br4 spinel EG Özdemir, Z Merdan, HAR Aliabad Journal of Magnetism and Magnetic Materials 590, 171671, 2024 | | 2024 |
| Fluorine derivatives of piceatannol for photobiological and photophysical applications by DFT approach M Azadparvar, HAR Aliabad, E Rezaei-Seresht, I Ahmad, H Sharafi Chemical Physics Letters 828, 140732, 2023 | | 2023 |
| First principle study of the optoelectronic properties of pyrazinamide drug HA Rahnamaye Aliabad, M Azadparvar, B Mahdavi, R Golestani, ... Optical and Quantum Electronics 55 (8), 714, 2023 | | 2023 |
| Optoelectronic and thermoelectric properties of Sb2S3 under hydrostatic pressure for energy conversion M Azadparvar, HA Rahnamaye Aliabad, EG Özdemir AIP Advances 13 (6), 2023 | 1 | 2023 |
| DFT study of sertraline hydrochloride antidepressant drug (vol 29, 144, 2023) HA Rahnamaye Aliabad, B Mahdavi, M Azadparvar, R Golestani, ... JOURNAL OF MOLECULAR MODELING 29 (5), 2023 | | 2023 |
| DFT study of sertraline hydrochloride antidepressant drug HAR Aliabad, B Mahdavi, M Azadparvar, R Golestani, Z Choopani Journal of molecular modeling 29 (5), 144, 2023 | | 2023 |
| Effects of the Hubbard potential on the NMR shielding and optoelectronic properties of BiMnVO5 compound HA Rahnamaye Aliabad, MA Iqbal, F Amiri-Shookoh, N Anwar, S Bakhsh, ... Scientific Reports 13 (1), 5816, 2023 | 1 | 2023 |
| Comparative DFT calculations on Bismuth-based compounds: new connection between optoelectronic properties and 209Bi and 51 V NMR and EFG F Amiri-Shookoh, HAR Aliabad, H Tavakoli-Anbaran Indian Journal of Physics 97 (3), 797-807, 2023 | | 2023 |
| Optoelectronic properties of La2CoO4 and LaSrCoO4 Ruddlesden-Popper compounds: Comparative experimental and DFT studies by GGA/MBJ+ U T Ghorbani-Moghadam, HAR Aliabad, M Mousavi Materials Science and Engineering: B 286, 116074, 2022 | 1 | 2022 |
| Fluorinated derivatives of tetrahydroaltersolanol molecule on COVID-19, HIV, and HTLV protease by DFT and molecular docking approaches M Azadparvar, M Kheirabadi, HAR Aliabad Journal of Molecular Modeling 28 (11), 350, 2022 | 3 | 2022 |
| Thermoelectric, optoelectronic and magnetic properties of BaLn2ZnO5 (Ln= Eu, Pr, Sm) insulators by GGA/mBJ+ U exchange-correlation approaches HAR Aliabad, H Vahidi, M Samsami, I Ahmad, GK Balci Materials Science and Engineering: B 283, 115772, 2022 | 2 | 2022 |
| Effect of fluorine substitution on the photobiological and electronic properties of resveratrol crystal structure: A first-principles study M Azadparvar, HAR Aliabad, E Rezaei-Seresht, M Mirzaei Journal of Photochemistry and Photobiology A: Chemistry 429, 113941, 2022 | 4 | 2022 |
| The electronic structure of graphene like C20H10CdN6O8. 5 metal-organic nanotube (MONT) based on FP-LAPW: for optoelectronic and thermoelectric devices HA Aliabad, H Vahidi, M Khalid, M Samsami, R Jawaria OPTICAL AND QUANTUM ELECTRONICS 54 (7), 2022 | | 2022 |
| The electronic structure of graphene like C20H10CdN6O8.5 metal–organic nanotube (MONT) based on FP-LAPW: for optoelectronic and thermoelectric devices HA Rahnamaye Aliabad, H Vahidi, M Khalid, M Samsami, R Jawaria Optical and Quantum Electronics 54 (7), 435, 2022 | | 2022 |
| Optoelectronic properties of C 66 H 54 Br 6 N 6 O 12 supramolecular nanotube by DFT studies HAR Aliabad, H Vahidi | | 2022 |
| Optical, electronic structure, magnetic, NMR and hyperfine field properties of BiMPO5 and BiM2PO6 compounds (M=Ni, Co, Mn, Cu): a comparative DFT study F Amiri-Shookoh, HA Rahnamaye Aliabad, H Tavakoli-Anbaran, ... Optical and Quantum Electronics 54 (6), 350, 2022 | 1 | 2022 |
| DFT investigations of AgMC7H10N2 (M = Cl, Br, and I) metal organic molecules: NMR, optoelectronic, and transport properties M Samsami, B Azadegan, HA Rahnamaye Aliabad, F Amiri-Shookoh Journal of Molecular Modeling 28 (6), 136, 2022 | 2 | 2022 |
