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Band bending is a central concept in solid-state physics that arises from local variations in charge distribution especially near semiconductor interfaces and surfaces. Its precision measurement is vital in a variety of contexts from the…

Search for low-dimensional materials with unique electronic properties is important for the development of electronic devices in nano scale. Through systematic first-principles calculations, we found that the band gaps of the…

Materials Science · Physics 2018-03-23 Xiaoxuan Ma , Jun Hu , Bicai Pan

Since the advent of graphene, two-dimensional (2D) materials become very attractive and there is growing interest to explore new 2D beyond graphene. Here, through density functional theory (DFT) calculations, we predict 2D wide-band-gap…

Mesoscale and Nanoscale Physics · Physics 2016-10-31 Xue-Jing Zhang , Bang-Gui Liu

Conventional semiconductors typically have bonding states near the valence band maximum (VBM) and antibonding states near the conduction band minimum (CBM). Semiconductors with the opposite electronic configuration, namely an antibonding…

Materials Science · Physics 2025-03-21 Zeyu Xiang , Fanghao Zhang , Bolin Liao

Before assessing the suitability of a semiconductor for specific applications, the first question to ask is whether it possesses a direct or indirect band gap. This distinction is fundamental, as the operation of devices such as…

The conventional distinction between semiconductors and insulators is often based on the magnitude of the band gap, with materials exhibiting gaps wider than 3 eV typically classified as insulators. However, the emergence of…

Two Dimensional (2D) Transition Metal Dichalcogenides (TMDs) possess a large direct band gap which has been experimentally observed to shrink with increasing charge carrier density (doping). The effect has been the subject of theoretical…

Mesoscale and Nanoscale Physics · Physics 2025-01-16 Jack N. Engdahl , Harley D. Scammell , Dmitry K. Efimkin , Oleg P. Sushkov

Two-dimensional (2D) semiconductors isoelectronic to phosphorene has been drawing much attention recently due to their promising applications for next-generation (opt)electronics. This family of 2D materials contains more than 400 members,…

Mesoscale and Nanoscale Physics · Physics 2017-08-17 Zhen Zhu , Baojuan Dong , Teng Yang , Zhi-Dong Zhang

We report pure carbon-based superlattices that exhibit direct band gaps and excellent optical absorption and emission properties at the threshold energy. The structures are nearly identical to that of cubic diamond except that defective…

Materials Science · Physics 2016-03-23 Young Jun Oh , Sunghyun Kim , In-Ho Lee , Jooyoung Lee , K. J. Chang

The direct bandgap found in hexagonal germanium and some of its alloys with silicon allows for an optically active material within the group-IV semiconductor family with various potential technological applications. However, there remain…

Materials Science · Physics 2024-04-12 Yetkin Pulcu , János Koltai , Andor Kormányos , Guido Burkard

A theoretical investigation is made of the dispersion characteristics of plasmons in a two-dimensional periodic system of semiconductor (dielectric) cylinders embedded in a dielectric (semiconductor) background. We consider both square and…

Mesoscale and Nanoscale Physics · Physics 2009-10-31 Manvir S. Kushwaha

We propose a novel concept of achieving silicon quantum dots with radiative rates enhanced by more than two orders of magnitude up to the values characteristic for direct band gap semiconductors. Our tight-binding simulations show how the…

Mesoscale and Nanoscale Physics · Physics 2015-06-19 A. N. Poddubny , K. Dohnalová

The quantum geometric properties of typical diamond-type (C, Si, Ge) and zincblende-type (GaAs, InP, etc) semiconductors are investigated by means of the $sp^{3}s^{\ast}$ tight-binding model, which allows to calculate the quantum metric of…

Strongly Correlated Electrons · Physics 2025-10-20 David Porlles , Wei Chen

Semiconductor superlattices have found widespread applications in electronic industries. In this work, short-period superlattice structure (SLs) composed of CdO and MgO layers was grown using the plasma-assisted molecular beam epitaxy…

Materials Science · Physics 2024-02-14 Abinash Adhikari , Pawel Strak , Piotr Dluzewski , Agata Kaminska , Ewa Przezdziecka

We have performed electronic structure calculations to explore the band-gap dependence on polytypes for $sp^3$-bonded semiconducting materials, i.e., SiC, AlN, BN, GaN, Si, and diamond. In this comprehensive study, we have found that…

Materials Science · Physics 2017-04-26 Yu-ichiro Matsushita , Atsushi Oshiyama

The $k \cdot p$ is a versatile technique that describes the semiconductor band structure in the vicinity of the bandgap. The technique can be extended to full Brillouin zone by including more coupled bands into consideration. For…

Other Condensed Matter · Physics 2007-05-23 C. Bulutay

With the development of modern nanoscience and nanotechnology, Bi1-xSbx can be synthesized into different nanoscale and nanostructured forms, including thin films, nanowires, nanotubes, nanoribbons, and many others. However, due to the…

Materials Science · Physics 2022-01-19 Shuang Tang , Jenna Jean-Baptiste , Schuyler Vecchiano , Adam Lukasiewicz , Alexandria Burger

The adoption of 3D packaging technology necessitates the development of new approaches to failure electronic device analysis. To that end, our team is developing a tool called the quantum diamond microscope (QDM) that leverages an ensemble…

We calculate the band gaps of 12 inorganic semiconductors and insulators composed of atoms from the first three rows of the periodic table using periodic equation-of-motion coupled-cluster theory with single and double excitations…

Materials Science · Physics 2023-10-09 Ethan A. Vo , Xiao Wang , Timothy C. Berkelbach

Channel knowledge map (CKM) is emerging as a critical enabler for environment-aware 6G networks, offering a site-specific database to significantly reduce pilot overhead. However, existing CKM construction methods typically rely on sparse…

Signal Processing · Electrical Eng. & Systems 2026-01-16 Le Zhao , Yining Wang , Xinyi Wang , Zesong Fei , Yong Zeng
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