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Oxygen vacancies are an important type of defect in transition metal oxides. In SrTiO$_3$ they are believed to be the main donors in an otherwise intrinsic crystal. At the same time, a relatively deep gap state associated with the vacancy…

Strongly Correlated Electrons · Physics 2013-11-21 Chungwei Lin , Alexander A. Demkov

With the advances in low dimensional transition metal dichalcolgenides (TMDCs) based metal oxide semiconductor field effect transistor (MOSFET), the interface between semiconductors and dielectrics has received considerable attention due to…

Computational Physics · Physics 2017-01-02 Sheng Yu , Shunjie Ran , Hao Zhu , Kwesi Eshun , Chen Shi , Kai Jiang , Qiliang Li

We have investigated the impact of toxic N2O gas upon structural and electronic properties of 2D MoSe2 monolayer using DFT approach. In this work, as a result of N2O gas absorption, charge transfer, band gap and density of states (DOS) are…

Materials Science · Physics 2020-08-18 N. Mishra , Bramha P. Pandey

Atomic vacancies, such as chalcogen vacancies in 2D TMDs, are important in changing the host material's electronic structure and transport properties. We present a straightforward one-step method for growing monolayer MoS2 utilizing…

Mesoscale and Nanoscale Physics · Physics 2024-05-28 Sudipta Majumder , Vaibhav Walve , Rahul Chand , Gokul M. A. , Sooyeon Hwang , G. V. Pavan Kumar , Aparna Deshpande , Atikur Rahman

We theoretically explore the effect of metal and disulphur vacancies on electronic and optical properties of MoS$_2$ and WS$_2$ monolayers based on a Slater-Koster tight-binding model and including the spin-orbit coupling. We show that the…

Mesoscale and Nanoscale Physics · Physics 2018-05-25 Saboura Salehi , Alireza Saffarzadeh

Combination of electric fields and Joule self-heating is used to change the oxygen stoichiometry and promote oxygen vacancy drift in a free-standing $\mathrm{(La,Sr)MnO_3}$ thin film microbridge placed in controlled atmosphere. By…

Strongly Correlated Electrons · Physics 2017-02-06 Nicola Manca , Luca Pellegrino , Daniele Marré

Interfaces between transition-metal oxides are able to host two-dimensional electron gases (2DEGs) and exhibit exotic quantum phenomena. Here we report the observation of superconductivity below 230 mK for the heterostructure composed of…

Superconductivity · Physics 2022-12-27 Haoran Wei , Shengru Chen , Yuting Zou , Yuxin Wang , Meng Yang , Qinghua Zhang , Lin Gu , Kun Jiang , Er-Jia Guo , Zhi Gang Cheng

This paper presents a VO2-based metamaterial absorber optimized for ultra-broadband, polarization-insensitive performance in the terahertz (THz) frequency range. The absorber consists of a patterned VO2 metasurface, a low-loss MF2…

Optics · Physics 2025-08-08 Robiul Hasan , Nafisa Anjum

Two dimensional transition metal dichalcogenides appear as good candidates for gas sensing and catalysis. Here, by means of density functional theory, we characterize the adsorption and dissociation of selected diatomic molecules (CO,…

Materials Science · Physics 2022-01-06 Raúl Bombín , Maite Alducin , Iñaki Juaristi

Aluminum monofluoride (AlF) is a suitable molecule for laser cooling and trapping. Such experiments require an extensive spectroscopic characterization of the electronic structure. Two of the theoretically predicted higher lying triplet…

Chemical Physics · Physics 2024-03-05 N. Walter , M. Doppelbauer , S. Schaller , X. Liu , R. Thomas , S. Wright , B. G. Sartakov , G. Meijer

Electronic states and their dynamics are of critical importance for electronic and optoelectronic applications. Here, we probe various relevant electronic states in monolayer MoS2, such as multiple excitonic Rydberg states and free-particle…

Semiconducting monolayer of 2D material are able to concatenate multiple interesting properties into a single component. Here, by combining opto-mechanical and electronic measurements, we demonstrate the presence of a partial 2H-1T phase…

While defects such as oxygen vacancies in correlated materials can modify their electronic properties dramatically, understanding the microscopic origin of electronic correlations in materials with defects has been elusive. Lanthanum…

Strongly Correlated Electrons · Physics 2021-02-24 Xingyu Liao , Vijay Singh , Hyowon Park

We discuss the applicability of the pseudopotential-like self-interaction correction (pSIC) to the study of defect energetics and electronic structure of In2O3. Our results predict that substitutional (at oxygen sites) and interstitial (at…

Materials Science · Physics 2016-06-24 Juan J. Meléndez , Małgorzata Wierzbowska

The quantum Hall conductance in monolayer graphene on an epitaxial SrTiO3 (STO) thin film is studied to understand the role of oxygen vacancies in determining the dielectric properties of STO. As the gate voltage sweep range is gradually…

Materials Science · Physics 2017-05-17 Kyeong Tae Kang , Haeyong Kang , Jeongmin Park , Dongseok Suh , Woo Seok Choi

HfO$_2$-based ferroelectrics have emerged as promising materials for advanced nanoelectronics, with their robust polarization and silicon compatibility making them ideal for high-density, non-volatile memory applications. Oxygen vacancies,…

Materials Science · Physics 2026-01-06 Yudi Yang , Wooil Yang , Young-Woo Son , Shi Liu

The compounds exhibit piezoelectricity, which demands to break inversion symmetry, and then to be a semiconductor. For $\mathrm{Ga_2O_3}$, the orthorhombic case ($\epsilon$-$\mathrm{Ga_2O_3}$) of common five phases breaks inversion…

Materials Science · Physics 2020-01-29 San-Dong Guo , Hui-Min Du

Unlike conventional epitaxy, van der Waals epitaxy (vdWE) allows nearly stress-free growth of thick films with highly oriented crystals without dislocations even for large film-substrate lattice mismatches. Despite reports of vdWE in…

The increasing demand for efficient hardware in neural computation highlights the limitations of electronic-based systems in terms of speed, energy efficiency, and scalability. Wavelength-division multiplexing (WDM) photonic neural networks…

Optics · Physics 2025-02-18 Jorge Parra , Juan Navarro-Arenas , Pablo Sanchis

In this paper, we show the direct correlation between suppression of polaronic oxygen vacancy defect (Vo) density and gas sensor response of 1 at% Mo doped $V_2O_5$ (MVONW) nanowires. Doping 1 at% $Mo^{5+}$ leads to substitution at the…

Mesoscale and Nanoscale Physics · Physics 2023-05-08 Anakha Anson , Dipanjana Mondal , Varsha Biswas , Kusuma Urs MB , Vinayak Kamble