7 citations · 8 across the 5 of their papers we have counts for
4 papers · 1 filter
Revealing Charge Transfer in Defect-Engineered 4Hb-TaS2
Siavash Karbasizadeh, Wooin Yang, Wonhee Ko +4
We present a comprehensive first-principles investigation of defects in 4-TaS. In this layered transition metal dichalcogenide, charge transfer between alternating Mott-in…
DFT-Guided Operando Raman Characterization of Ni-Based Phases Relevant to Electrochemical Systems
Harol Moreno Fernández, Siavash Karbasizadeh, Esmaeil Adabifiroozjaei +3
We present a phase-resolved investigation of Ni-based oxides and hydroxides relevant to the oxygen evolution reaction (OER), combining ground-state DFT+U calculations with operando…
Large Bandgap Observed on the Surfaces of EuZn2As2 Single Crystals
Dejia Kong, Siavash Karbasizadeh, Ganesh Narasimha +7
EuM2As2 (M = Zn, Cd, In, Sn etc.) is an excellent material system for studying topological properties, which can be easily tuned by magnetism involved. Theoretical calculations pre…
Impact of Ge, Ga, and Al doping on the mechanical and electronic properties of CrSi: insights from first-principles calculations
Siavash Karbasizadeh, Mohammad Amirabbasi
This study systematically investigates the effects of Ge, Ga, and Al doping on the mechanical and electronic properties of cubic CrSi using first-principles density functional…