The investigation of optoelectronic, magnetic and dynamical properties of Ce and Ti doped 2D blue phosphorene: A dispersion corrected DFT study
R.M. Arif Khalil, Fayyaz Hussain, Muhammad Iqbal Hussain, Afshan Parveen, Muhammad Imran, G. Murtaza, M. A. Sattar, Anwar Manzoor Rana, Sungjun Kim
Topics & Concepts
PhosphoreneDensity functional theoryBand gapMaterials scienceCASTEPDopingBlueshiftPhononVacancy defectRaman spectroscopyCondensed matter physicsDispersion (optics)Molecular physicsOptoelectronicsChemistryComputational chemistryOpticsPhotoluminescencePhysics2D Materials and ApplicationsMXene and MAX Phase MaterialsPerovskite Materials and Applications