T. Berlijn

activity

20242026

most citedA Pathway to Efficient Simulations of Charge Density Waves in Transition Metal Dichalcogenides: A Case Study for TiSe2

11 citations · 18 across the 5 of their papers we have counts for

collaborators

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2 papers · 1 filter

cond-mat.mtrl-sci2026

Charge-Density-Wave Phase Transitions in Monolayer 1T-TaS2 from Universal Machine Learning Molecular Dynamics

Valentina Nesterova, Tribhuwan Pandey, Tom Berlijn +3

Charge-density-wave (CDW) phases in 1T transition-metal dichalcogenides arise from strong electron-phonon coupling and accompanying lattice instabilities. Capturing their temperatu…

cond-mat.mtrl-sci2026

Revealing Charge Transfer in Defect-Engineered 4H $_{b}$ -TaS $_{2}$

Siavash Karbasizadeh, Wooin Yang, Wonhee Ko +4

We present a comprehensive first-principles investigation of defects in 4 $H_{b}$ -TaS $_{2}$ . In this layered transition metal dichalcogenide, charge transfer between alternating Mott-in…

Charge-Density-Wave Phase Transitions in Monolayer 1T-TaS2 from Universal Machine Learning Molecular Dynamics

Revealing Charge Transfer in Defect-Engineered 4Hb​-TaS2​

Revealing Charge Transfer in Defect-Engineered 4H $_{b}$ -TaS $_{2}$