Schottky barrier lowering due to interface states in 2D heterophase devices
arXiv:1911.09521 · doi:10.1039/D0NA00795A
Abstract
The Schottky barrier of a metal-semiconductor junction is one of the key quantities affecting the charge transport in a transistor. The Schottky barrier height depends on several factors, such as work function difference, local atomic configuration in the interface, and impurity doping. We show that also the presence of interface states at 2D metal-semiconductor junctions can give rise to a large renormalization of the effective Schottky barrier determined from the temperature dependence of the current. We investigate the charge transport in n- and p-doped monolayer MoTe 1T'-1H junctions using ab-initio quantum transport calculations. The Schottky barriers are extracted both from the projected density of states and the transmission spectrum, and by simulating the IT-characteristic and applying the thermionic emission model. We find interface states originating from the metallic 1T' phase rather than the semiconducting 1H phase in contrast to the phenomenon of Fermi level pinning. Furthermore, we find that these interface states mediate large tunneling currents which dominates the charge transport and can lower the effective barrier to a value of only 55 meV.
arXiv comment6 figures
References in corpus (13)
- The PseudoDojo: Training and grading a 85 element optimized norm-conserving pseudopotential table
- QuantumATK: An integrated platform of electronic and atomic-scale modelling tools
- Optical Spectrum of MoS: Many-body Effects and Diversity of Exciton States
- The Computational 2D Materials Database: High-Throughput Modeling and Discovery of Atomically Thin Crystals
- Computational 2D Materials Database: Electronic Structure of Transition-Metal Dichalcogenides and Oxides
- Layer-dependent Band Alignment and Work Function of Few-Layer Phosphorene
- Van der Waals metal-semiconductor junction: weak Fermi level pinning enables effective tuning of Schottky barrier
- Atomically-thin Ohmic Edge Contacts Between Two-dimensional Materials
- General atomistic approach for modeling metal-semiconductor interfaces using density functional theory and non-equilibrium Green's function
- Universal Scaling Laws in Schottky Heterostructures Based on Two-Dimensional Materials
- Immunity to Scaling in MoS2 Transistors Using Edge Contacts
- Engineering of Neutral Excitons and Exciton Complexes in Transition Metal Dichalcogenide Monolayers through External Dielectric Screening
- First-Principles Electron Transport with Phonon Coupling: Large-Scale at Low Cost
Cited by in corpus (4)
- First-Principles Theory for Schottky Barrier Physics
- Vertical Heterostructures between Transition-Metal Dichalcogenides -- A Theoretical Analysis of the NbS/WSe junction
- Assessing the role of quantum effects in 2D heterophase MoTe field effect transistors
- A back-to-back diode model applied to MoS2 van der Waals Schottky diodes