m.alaei@iut.ac.ir Google Scholar Office Department of Physics Phone 031-33913704 Fax 031-33912376 Positions Department of Physics Research Interests Condensed Matter Physics Computational Physics Density Functional Theory type: Journal Title DOI type Predicting superconducting transition temperature through advanced machine learning and innovative feature engineering 10.1038/s41598-024-54440-y Journal Driven charge density modulation by spin density wave and their coexistence interplay in SmFeAsO: A first-principles study 10.1016/j.physb.2023.415603 Journal Benchmarking density functional theory on the prediction of antiferromagnetic transition temperatures 10.1103/PhysRevB.108.144413 Journal A deep investigation of NiO and MnO through the first principle calculations and Monte Carlo simulations 10.1088/2516-1075/acbff8 Journal Novel first-principles insights into graphene fluorination 10.1063/5.0091279 Journal ESpinS: A program for classical Monte-Carlo simulations of spin systems 10.1016/j.commatsci.2021.110947 Journal Machine learning for compositional disorder: A comparison between different descriptors and machine learning frameworks 10.1016/j.commatsci.2022.111284 Journal Band structure engineering in gallium sulfide nanostructures 10.1007/s00339-020-04184-z Journal Ab-initio search for efficient red thermally activated delayed fluorescence molecules for organic light emitting diodes 10.1016/j.saa.2020.118952 Journal Ab initio determination of the magnetic ground state of pyrochlore Y2Mn2O7 10.1103/PhysRevB.102.125105 Journal
