Driven charge density modulation by spin density wave and their coexistence interplay in SmFeAsO: A first-principles study

T Morshedloo, A Kazempour, H Shakeripour… - Physica B: Condensed …, 2024 - Elsevier
We use density functional theory to investigate effects of spin-orbit coupling and single-stripe-
type antiferromagnetic (sAFM) ordering on the crystal structure and electronic properties of …

Emergence of Phonon‐Mediated Superconductivity in Electron‐Doped Monolayer WS2: First‐Principles Study

SK Maroju, A Samudrala - physica status solidi (RRL)–Rapid …, 2024 - Wiley Online Library
Herein, the electronic properties for undoped and carrier‐doped tungsten disulfide (WS2)
monolayer are systematically examined by using ab initio calculations. The results show that …