Mohammed Reza Jangrouei

I am focused on research in Computational Modeling of Quantum Chemistry, along with Molecular Laser Spectroscopy and Condensed Matter Physics. My current project, "A computational method for describing intermolecular interactions in excited states," aims to bridge a significant gap in the field of computational chemistry. The goal is to develop a method that both precisely and efficiently describes noncovalent interactions in excited states.

  • M. R. Jangrouei, A. Krzemińska-Kowalska, M. Hapka, E. Pastorczak, K. Pernal, Dispersion Interactions in Exciton-Localized States. Theory and Applications to π–π* and n−π* Excited States, J. Chem. Theory Comput. 18(6), 3497-3511, 2022
  • M. R. Jangrouei, K. Pernal, O. Gritsenko, On-top description of the effect of excitation on electron correlation with quasiparticles, Phys. Rev. A 104(2), 022804, 2021
  • M. R. Jangrouei, K. Pernal, O. Gritsenko, Universal on-top description of electron correlation in the ground and excited many-electron states with correlon quasiparticles, Phys. Rev. A 102(5), 052829, 2020
  • M. R. Jangrouei, S. J. Hashemifar, First-principles insights into ultrashort laser spectroscopy of molecular nitrogen, J. Electron Spectrosc. Relat. Phenom. 225, 36-41, 2018
  • M. R. Jangrouei, S. J. Hashemifar, First-principles insights into ultrashort laser spectroscopy of molecular nitrogen, J. Electron Spectrosc. Relat. Phenom. 225(225), 36-41, 2018

  • M. R. Jangrouei, Wireless Power Transmission via the effects of laser on quantum dot solar cells, 3rd International researching Conference on Science and Engineering, Bangkok, Thailand, 2017
  • M. R. Jangrouei, H. S. Javad, H. Roohollah, Time-dependent density functional study of the effects of short laser pulses on N2 molecule, 12th Conference on Condensed Matter, Isfahan, Iran, 2015

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