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- W4323667030 abstract "Abstract Quantum transport simulations based on the Non-Equilibrium Green’s Function formalism require accurate integration of the charges in the system. We demonstrate our implementation of a full-band integration scheme, which automatically incorporates electronic screening effects and is predicted to incorporate interface charges more correctly than the simpler excess charge approach. We show that for single doping type purely semiconducting devices, the two approaches are equivalent. We also highlight the influence of using the full-band approach for devices containing metals." @default.
- W4323667030 created "2023-03-10" @default.
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- W4323667030 date "2023-03-09" @default.
- W4323667030 modified "2023-10-18" @default.
- W4323667030 title "Full Band Incorporation in Ab-initio Simulations of Two-dimensional Semiconductor Based Devices" @default.
- W4323667030 doi "https://doi.org/10.21203/rs.3.rs-2653141/v1" @default.
- W4323667030 hasPublicationYear "2023" @default.
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