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We develop the tight-binding model to study electronic and optical properties of graphane. The strong sp3 chemical bondings among the carbon and hydrogen atoms induce a special band structure and thus lead to the rich optical excitations.…

Materials Science · Physics 2016-10-31 M. H. Lee , H. C. Chung , J. M. Lu , C. P. Chang , M. F. Lin

We present the electrical transport characteristics of a batch of nano-crystalline diamond films of varying nitrogen concentrations and explain the conduction mechanism by the disordered quasi-superlattice model applied to semiconductor…

Mesoscale and Nanoscale Physics · Physics 2015-06-05 George Chimowa , Dimitry Churochkin , Somnath Bhattacharyya

Two-dimensional crystals, single sheets of layered materials, often show distinct properties desired for optoelectronic applications, such as larger and direct band gaps, valley- and spinorbit effects. Being atomically thin, the low amount…

Materials Science · Physics 2018-11-14 Roman Kempt , Agnieszka Kuc , Jae Hyo Han , Jinwoo Cheon , Thomas Heine

A major challenge in creating a quantum computer is to find a quantum system that can be used to implement the qubits. For this purpose, deep centers are prominent candidates, and ab initio calculations are one of the most important tools…

Materials Science · Physics 2017-08-30 Bruno Lucatto , Lucy V. C. Assali , Ronaldo Rodrigues Pela , Marcelo Marques , Lara K. Teles

The ability to manipulate two-dimensional (2D) electrons with external electric fields provides a route to synthetic band engineering. By imposing artificially designed and spatially periodic superlattice (SL) potentials, 2D electronic…

Usually, in optical spectra of double-walled carbon nanotubes (DWCNTs) weak van der Waals coupling between the layers leads only to a small shift of transition energies with respect to their values in pristine single-walled nanotubes.…

Mesoscale and Nanoscale Physics · Physics 2020-09-30 D. V. Chalin , S. B. Rochal

Diamond bulk irradiated with a free-electron laser pulse of 6100 eV photon energy, 5 fs duration, at the $\sim 19-25$ eV/atom absorbed doses, is studied theoretically on its way to warm dense matter state. Simulations with our hybrid code…

Materials Science · Physics 2018-03-30 Nikita Medvedev , Beata Ziaja

Recently, a new carbon 3D carbon allotrope named pentadiamond was proposed. Pentadiamond is composed of carbon atoms in mixed sp$^2$ and sp$^3$-like hybridization. In this work, we have carried out a detailed investigation of the electronic…

Materials Science · Physics 2021-02-03 Raphael M. Tromer , Levy C. Felix , Cristiano F. Woellner , Douglas S. Galvao

It is difficult to intuit how electronic structure features$-$such as band gap magnitude, location of band extrema, effective masses, etc.$-$arise from the underlying crystal chemistry of a material. Here we present a strategy to distill…

Materials Science · Physics 2024-12-25 Emily Oliphant , Veda Mantena , Madison Brod , G. Jeffrey Snyder , Wenhao Sun

Employing density functional theory based calculations, we investigate structural, vibrational and strain-dependent electronic properties of an ultra-thin CdTe crystal structure that can be de- rived from its bulk counterpart. It is found…

Mesoscale and Nanoscale Physics · Physics 2017-11-15 Fadil Iyikanat , Baris Akbali , Jun Kang , R. Tugrul Senger , Yusuf Selamet , Hasan Sahin

We show that patterned defects can be used to disrupt the sub-lattice symmetry of graphene so as to open up a band gap. This way of modifying graphene's electronic structure does not rely on external agencies, the addition of new elements…

Mesoscale and Nanoscale Physics · Physics 2010-09-09 David J. Appelhans , Zhibin Lin , Mark T. Lusk

Geometry, whether on the atomic or nanoscale, is a key factor for the electronic band structure of materials. Some specific geometries give rise to novel and potentially useful electronic bands. For example, a honeycomb lattice leads to…

Color centers in diamond provide a promising platform for quantum optics in the solid state, with coherent optical transitions and long-lived electron and nuclear spins. Building upon recent demonstrations of nanophotonic waveguides and…

We have theoretically investigated two-band models of graded-gap superlattices within the envelope-function approximation. Assuming that the gap varies linearly with spatial coordinate, we are able to find exact solutions of the…

Condensed Matter · Physics 2015-06-25 B. Mendez , F. Dominguez-Adame

We study radiative energy transfer between a donor-acceptor pair across a hyperbolic metamaterial slab. We show that similar to a perfect lens a hyperbolic lens allows for giant energy transfer rates. For a realistic realization of a…

Mesoscale and Nanoscale Physics · Physics 2016-09-07 S. -A. Biehs , V. M. Menon , G. S. Agarwal

Superlattice engineering provides the means to reshape the fabric felt by quasiparticles moving in a material. Here we argue that bandstructure engineering with superlattices can be pushed to the extreme limit by stacking gapped van der…

Mesoscale and Nanoscale Physics · Physics 2020-01-15 Li-kun Shi , Jing Ma , Justin C. W. Song

We propose and realize a deeply sub-wavelength optical lattice for ultracold neutral atoms using $N$ resonantly Raman-coupled internal degrees of freedom. Although counter-propagating lasers with wavelength $\lambda$ provided two-photon…

On-chip integrated light sources are essential for photonic integrated circuits, requiring waveguides to interface various components, from light sources to detectors. Two-dimensional (2D) transition metal dichalcogenide (TMD)…

We have measured the reflectivity spectra of the iron based superconductor LiFeAs (Tc = 17.6 K) in the temperature range from 4 to 300 K. In the superconducting state (T < Tc), the clear opening of the optical absorption gap was observed…

Diamond-like carbon thin films have emerged as durable, chemically stable optical coatings for many optical and optoelectronics applications due to their hardness, chemical inertness, and optical transparency. This paper presents a novel…

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