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Charge density waves (CDW) and their concomitant periodic lattice distortions (PLD) govern the electronic properties in many layered transition-metal dichalcogenides. In particular, 1T-TaS2 undergoes a metal-to-insulator phase transition as…

Two-dimensional (2D) semiconducting transition metal dichalcogenides such as MoS$_2$ have attracted extensive research interests for potential applications in optoelectronics, spintronics, photovoltaics, and catalysis. To harness the…

Materials Science · Physics 2020-07-01 Anne Marie Z. Tan , Christoph Freysoldt , Richard G. Hennig

Following letter introduces a theoretical approach to investigate the effect of two-step GaN barrier layer growth methodology on the performance of InGaN/GaN MQW solar cell, in which a lower temperature GaN cap layer was grown on top of…

Mesoscale and Nanoscale Physics · Physics 2016-05-24 Saina Haghkish , Asghar Asgari

We investigate the self-compensation mechanism in phosphorus-doped CdTe. The formation energies, charge transition levels, and defects states of several P-related point defects susceptible to cause self-compensation are addressed by…

Materials Science · Physics 2017-10-20 Mauricio A. Flores , Walter Orellana , Eduardo Menéndez-Proupin

Using angle-resolved photoemission spectroscopy (ARPES) and density functional theory (DFT), an experimental and theoretical study of changes in the electronic structure (dispersion dependencies) and corresponding modification of the energy…

Zinc Phosphide ($Zn_3P_2$) could be the basis for cheap and highly efficient solar cells. Its use in this regard is limited by the difficulty in n-type doping the material. In an effort to understand the mechanism behind this, the…

Materials Science · Physics 2012-03-06 Steven Demers , Axel van de Walle

In this study, effects of the shell material and confinement type on the conversion efficiency of the core/shell quantum dot nanocrystal (QDNC) solar cells have been investigated in a detail manner. For this purpose, the conventional, i.e…

Applied Physics · Physics 2018-04-18 Mehmet Sahin

Ultrathin CrSBr flakes are exfoliated \emph{in situ} on Au(111) and Ag(111) and their electronic structure is studied by angle-resolved photoemission spectroscopy. The thin flakes' electronic properties are drastically different from those…

The lattice mismatch strain field of core/multishell structures with spherical symmetry is modeled by a linear continuum elasticity approach. The effect of the strain on the energy structure and linear optical absorption in large…

Optics · Physics 2015-06-22 Tudor E. Pahomi , Tiberius O. Cheche

Charge density wave (CDW) is a collective quantum phenomenon in metals and features a wave-like modulation of the conduction electron density. A microscopic understanding and experimental control of this many-body electronic state in…

Materials Science · Physics 2022-01-19 Ming-Qiang Ren , Sha Han , Jia-Qi Fan , Shujing Li , Shu-Ze Wang , Fawei Zheng , Ping Zhang , Xu-Cun Ma , Qi-Kun Xue , Can-Li Song

Although the power conversion efficiencies of organic solar cells (OSCs) have surpassed 20%, they still lag behind commercial inorganic solar cells and emerging perovskite solar cells. To bridge this efficiency gap, improving the fill…

By means of the first-principles density functional theory (DFT), I2-II-IV-VI4 type Cu-based quaternary chalcogenides Cu 2 XSiS 4 (X = Ge, Sn, and Pb) have been thoroughly investigated. We report the study of Ge and Sn substitution in the…

Materials Science · Physics 2025-09-26 H. Laltlanmawii , L. Celestine , R. Zosiamliana , B. Chettri , S. Bhattarai , K. C. Bhamu , D. P. Rai

Solar cells with a heterojunction between colloidal CuInS$_2$ and ZnO nanocrystals are an innovative concept in solution-processed photovoltaics, but the conversion efficiency cannot compete yet with devices employing lead chalcogenide…

Applied Physics · Physics 2019-05-10 Dorothea Scheunemann , Sebastian Wilken , Jürgen Parisi , Holger Borchert

Upgraded metallurgical grade (UMG) silicon (Si) has raised interest as an alternative material for solar cells due to its low cost, low environmental impact and low CAPEX. Maximum cell efficiencies at the level of those obtained from high…

Conduction and valence band-edge-property variations with position as well as defects giving rise to localized states in the energy gap can play a significant role in determining solar cell performance. Understanding their effects on a…

Applied Physics · Physics 2019-08-15 Yiming Liu , Stephen Fonash

The results of our researches of the influence of exponentially distributed surface centers on the effective surface recombination rate and the parameters of silicon solar cells (SCs) are reported. In our calculations, we assumed the…

Materials Science · Physics 2013-04-30 V. P. Kostylyov , A. V. Sachenko , I. O. Sokolovskyi , V. V. Chernenko , T. V. Slusar , A. V. Sushyi

The effects of thickness, doping concentration and recombination of AlSb films on the performance of CdS/AlSb cells are simulated by one dimensional simulation program called analysis of microelectronic and photonic structures(AMPS1D) soft…

Applied Physics · Physics 2021-06-07 Huijin Song , Zilong Wang , Jingwen Wang , Qiang Yan , Kai Xia , Xiangfeng Deng , Minqiang Li

A density functional theory study of NbSe$_2$ single-layers in the normal non-modulated and the $3\times3$ CDW states is reported. We show that, in the single layer, the CDW barely affects the Fermi surface of the system, thus ruling out a…

Materials Science · Physics 2016-10-05 J. A. Silva-Guillén , P. Ordejón , F. Guinea , E. Canadell

In this paper we investigate the effect of Cd doping at ultra-low concentrations in SnO$_2$ both experimentally, by measuring the temperature dependence of the electric quadrupole hyperfine interactions with time-differential perturbed…

Materials Science · Physics 2019-01-23 Germán N. Darriba , Emiliano L. Muñoz , Artur W. Carbonari , Mario Rentería

Complex materials encompassing different phases of matter can display new photoinduced metastable states differing from those attainable under equilibrium conditions. These states can be realized when energy is injected in the material…

Strongly Correlated Electrons · Physics 2024-06-27 Wibke Bronsch , Manuel Tuniz , Denny Puntel , Alessandro Giammarino , Fulvio Parmigiani , Yang-hao Chan , Federico Cilento
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