5 citations · 13 across the 4 of their papers we have counts for
4 papers
Interface Magnetism in Vanadium-doped MoS/Graphene Heterostructures
Diem Thi-Xuan Dang, Yen Thi-Hai Pham, Da Zhou +4
Magnetism in two-dimensional materials is of great importance in discovering new physical phenomena and developing new devices at the nanoscale. In this paper, first-principles sim…
Twisting in h-BN bilayers and their angle-dependent properties
Diem Thi-Xuan Dang, Dai-Nam Le, Lilia M. Woods
In this paper, we systematically investigate the structural and electronic properties of twisted h-BN bilayers to understand the role of the twisting angle. Using first-principles…
Dissecting van der Waals interactions with Density Functional Theory -- Wannier-basis approach
Diem Thi-Xuan Dang, Dai-Nam Le, Lilia M. Woods
A new scheme for the computation of dispersive interactions from first principles is presented. This cost-effective approach relies on a Wannier function representation compatible…
Vanadium-Doped Molybdenum Disulfide Monolayers with Tunable Electronic and Magnetic Properties: Do Vanadium-Vacancy Pairs Matter?
Da Zhou, Yen Thi Hai Pham, Diem Thi-Xuan Dang +12
Monolayers of molybdenum disulfide (MoS2) are the most studied two-dimensional (2D) transition-metal dichalcogenides (TMDs), due to its exceptional optical, electronic, and opto-el…