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We present a first-principles study of the structural, electronic, and optical properties of hydrogenated amorphous silicon (a-Si:H). To this end, atomic configurations of a-Si:H with 72 and 576 atoms respectively are generated using…

材料科学 · 物理学 2017-03-31 Philippe Czaja , Urs Aeberhard , Massimo Celino , Simone Giusepponi , Michele Gusso

The improvement of light absorption in Si/BeSe$_{0.41}$Te$_{0.59}$ heterostructures for solar cell applications is studied theoretically. First, using simple approaches we found that light absorption could be improved in a single…

介观与纳米尺度物理 · 物理学 2007-05-23 T. Sandu , W. P. Kirk

The effect of quantum confinement in the optical absorption spectra of atomically thin {\alpha}-In2Se3 crystals is studied, observing a huge thickness-dependent shift in the optical band gap of exfoliated {\alpha}-In2Se3 flakes. The band…

介观与纳米尺度物理 · 物理学 2016-10-19 Jorge Quereda , Robert Biele , Gabino Rubio-Bollinger , Nicolás Agraït , Roberto D'Agosta , Andres Castellanos-Gomez

We report on very high enhancement of thin layer's absorption through band-engineering of a photonic crystal structure. We realized amorphous silicon (aSi) photonic crystals, where slow light modes improve absorption efficiency. We show…

On the basis of density functional calculations and using Bader's atom in molecule theory, this article presents quantitative microscopic analyses on the bonding properties of amorphous silicon (a-Si) which could reflect in the observable…

材料科学 · 物理学 2019-04-11 Zahra Nourbakhsh , Hadi Akbarzadeh

Optical and thermal effects in asymmetric supercapacitors, whose active-carbon (AC) electrodes were embedded with nano-Si (n-Si) quantum dots (QD), are reported. We describe two structures: (1) p-n like, obtained by using a polyethylimine…

化学物理 · 物理学 2020-12-17 H. Grebel

In this paper, we analyse the optical absorption in porous silicon . This is the first attempt to explicitly demonstrate that it is not possible to extract the band gap of such low dimensional nanostructures like porous silicon from a Tauc…

软凝聚态物质 · 物理学 2007-05-23 Shouvik Datta , K. L. Narasimhan

Silicon's inherently indirect bandgap severely limits its radiative efficiency, posing a fundamental challenge to the development of practical silicon-based light sources. While strategies such as nanoscale confinement of electrons and…

By means of ab-initio calculations we investigate the optical properties of pure a-SiN$_x$ samples, with $x \in [0.4, 1.8]$, and samples embedding silicon nanoclusters (NCs) of diameter $0.5 \leq d \leq 1.0$ nm. In the pure samples the…

介观与纳米尺度物理 · 物理学 2012-05-03 R. Guerra , M. Ippolito , S. Meloni , S. Ossicini

Since thin-film silicon solar cells have limited optical absorption, we explore the effect of a nanostructured back reflector to recycle the unabsorbed light. As a back reflector we investigate a 3D photonic band gap crystal made from…

We present a theoretical analysis of intraband optical transitions from the intermediate pseudo-band of confined states to the conduction band in a finite, inhomogeneous stack of self-assembled semiconductor quantum dots. The chain is…

介观与纳米尺度物理 · 物理学 2015-03-20 Igor Bragar , Paweł Machnikowski

We report on simulations and measurements of the optical absorption of silicon nanowires (NWs) versus their diameter. We first address the simulation of the optical absorption based on two different theoretical methods : the first one,…

We study optical properties of two dimensional silicene using density functional theory based calculations. Our results on optical response property calculations show that they strongly depend on direction of polarization of light, hence…

介观与纳米尺度物理 · 物理学 2012-05-24 Kamal Chinnathambi , Aparna Chakrabarti , Arup Banerjee , S. K. Deb

We study the spectral properties of electron quantum dots (QDs) confined in 2D parabolic harmonic oscillator influenced by external uniform electrical and magnetic fields together with an Aharonov-Bohm (AB) flux field. We use the…

介观与纳米尺度物理 · 物理学 2012-09-26 Sameer M. Ikhdair , Majid Hamzavi , Ramazan Sever

In this paper, optical and electronic properties of diamond shaped graphene quantum dots (DQDs) have been studied by employing large-scale electron-correlated calculations. The computations have been performed using the \pi-electron…

介观与纳米尺度物理 · 物理学 2015-11-16 Tista Basak , Himanshu Chakraborty , Alok Shukla

Demonstrating the quantum-confined Stark effect (QCSE) in silicon nanocrystals (NCs) embedded in oxide has been rather elusive, unlike the other materials. Here, the recent experimental data from ion-implanted Si NCs is unambiguously…

介观与纳米尺度物理 · 物理学 2010-04-23 Ceyhun Bulutay , Mustafa Kulakci , Raşit Turan

Semiconductor coupled quantum dots provide a unique opportunity of tuning bandgaps by tailoring band offsets, making them ideal for photovoltaic and other applications. Here, we have studied stability, trends in the band gap, band offsets,…

介观与纳米尺度物理 · 物理学 2022-08-16 Arup Chakraborty , Bidisa Das , Indra Dasgupta

Here we embark on a thorough investigation of the magneto-optical absorption in semiconducting {\em spherical} quantum dots characterized by a confining harmonic potential and an applied magnetic field in the symmetric gauge. This is done…

介观与纳米尺度物理 · 物理学 2016-04-13 Manvir S. Kushwaha

The optical absorption of a single spherical semiconductor quantum dot in an electrical field is studied taking into account the nonlocal coupling between the field of the light and the polarizability of the semiconductor. These nonlocal…

介观与纳米尺度物理 · 物理学 2009-10-31 F. Thiele , Ch. Fuchs , R. v. Baltz

Band gap modification for small-diameter (1 nm) silicon nanowires resulting from the use of different species for surface termination is investigated by density functional theory calculations. Because of quantum confinement, small-diameter…

材料科学 · 物理学 2010-02-03 Michael Nolan , Sean O'Callaghan , Giorgos Fagas , James C. Greer , Thomas Frauenheim
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