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Updated: Dec 21, 2025

Probe Type II Band Alignment in One-Dimensional Van Der Waals Heterostructures Using First-Principles Calculations
Published on: October 12, 2019
Band alignment at interfaces of two-dimensional materials: internal photoemission analysis
Valery V Afanas'ev1, Gilles Delie1, Michel Houssa1
1Laboratory of Semiconductor Physics, Department of Physics and Astronomy, University of Leuven, Belgium.
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The article overviews experimental results obtained by applying internal photoemission (IPE) spectroscopy methods to characterize electron states in single- or few-monolayer thick two-dimensional materials and at their interfaces. Several conducting (graphene) and semiconducting (transitional metal dichalcogenides MoS2, WS2, MoSe2, and WSe2) films on top of thermal SiO2have been analyzed by IPE, which reveals significant sensitivity of interface band offsets and barriers to the details of the material and interface fabrication, indicating violation of the Schottky-Mott rule. This variability is associated with charges and dipoles formed at the interfaces with van der Waals bonding as opposed to the chemically bonded interfaces of three-dimensional semiconductors and metals. Chemical modification of the underlying SiO2surface is shown to be a significant factor, affecting interface barriers due to violation of the interface electroneutrality.

