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In this paper, we compute the band structure of one- and two-dimensional phononic composites using the extended finite element method (X-FEM) on structured higher-order (spectral) finite element meshes. On using partition-of-unity…

Computational Physics · Physics 2021-11-09 Eric B. Chin , Amir Ashkan Mokhtari , Ankit Srivastava , N. Sukumar

Calculations of the photonic band structure, transmission coefficients, and quality factors of various two-dimensional, periodic and aperiodic, dielectric photonic crystals by using the finite element method (FEM) are reported. The…

Mesoscale and Nanoscale Physics · Physics 2015-06-11 Imanol Andonegui , Angel J. Garcia-Adeva

We consider the calculation of the band structure of frequency dependent photonic crystals. The associated eigenvalue problem is nonlinear and it is challenging to develop effective convergent numerical methods. In this paper, the band…

Numerical Analysis · Mathematics 2020-07-23 Wenqiang Xiao , Bo Gong , Jiguang Sun , Zhimin Zhang

We develop a formalism for the calculation of the frequency band structure of a phononic crystal consisting of non-overlapping elastic spheres, characterized by Lam\'e coefficients which may be complex and frequency dependent, arranged…

Materials Science · Physics 2009-10-31 I. E. Psarobas , N. Stefanou , A. Modinos

We develop an approach to design, engineer, and measure band structures in a synthetic crystal composed of electric circuit elements. Starting from the nodal analysis of a circuit lattice in terms of currents and voltages, our Laplacian…

Mesoscale and Nanoscale Physics · Physics 2019-05-01 Tobias Helbig , Tobias Hofmann , Ching Hua Lee , Ronny Thomale , Stefan Imhof , Laurens W. Molenkamp , Tobias Kiessling

We propose a new method to compute band structures of dispersive photonic crystals. It can treat arbitrarily frequency-dependent, lossy or lossless materials. The band structure problem is first formulated as the eigenvalue problem of an…

Numerical Analysis · Mathematics 2020-10-06 Wenqiang Xao , Jiguang Sun

Photonic crystals (PhCs) are periodic dielectric structures that exhibit unique electromagnetic properties, such as the creation of band gaps where electromagnetic wave propagation is inhibited. Accurately predicting dispersion relations,…

Numerical Analysis · Mathematics 2024-11-12 Yueqi Wang , Richard Craster , Guanglian Li

The high-symmetry pseudocubic init cell is often used for modelling the electronic structure of halide perovskites. However, direct comparison of the band structure with more realistic low-symmetry phases is impeded by the zone folding. We…

Materials Science · Physics 2015-08-17 O. Rubel , A. Bokhanchuk

The vibrational properties of two-dimensional phononic crystals are studied with large-scale molecular dynamics simulations and finite element method calculation. The vibrational band structure derived from the molecular dynamics…

Materials Science · Physics 2017-11-28 Ralf Meyer

We address the energy spectrum of honeycomb lattice with various defects or impurities under a perpendicular magnetic field. We use a tight-binding Hamiltonian including interactions with the nearest neighbors and investigate its energy…

Mesoscale and Nanoscale Physics · Physics 2018-05-16 Yoshiyuki Matsuki , Kazuki Ikeda

Manipulating the dispersive characteristics of vibrational waves is beneficial for many applications, e.g., high-precision instruments. architected hierarchical phononic materials have sparked promise tunability of elastodynamic waves and…

We describe procedures to obtain the electronic structure of disordered systems using either tight binding like models or quite directly from ab inito density functional band structure calculations. The band structure is calculated using…

Materials Science · Physics 2011-09-20 M. W. Haverkort , I. S. Elfimov , G. A. Sawatzky

Band theory provides the foundation for understanding electronic structure in crystalline materials, but its reliance on exact translational symmetry limits its applicability to systems with defects, disorder, incommensurate modulations, or…

Materials Science · Physics 2026-05-08 Christopher A. Bairnsfather , Ralph M. Kaufmann , Terry A. Loring , Alexander Cerjan

Supercells are often used in ab initio calculations to model compound alloys, surfaces and defects. One of the main challenges of supercell electronic structure calculations is to recover the Bloch character of electronic eigenstates…

Materials Science · Physics 2014-09-12 O. Rubel , A. Bokhanchuk , S. J. Ahmed , E. Assmann

A high-frequency asymptotic scheme is generated that captures the motion of waves within discrete hexagonal and honeycomb lattices by creating continuum homogenised equations. The accuracy of these effective medium equations in describing…

Materials Science · Physics 2013-11-01 Mehul Makwana , Richard Craster

The refraction properties of phononic crystals are revealed by examining the anti-plane shear waves in doubly periodic elastic composites with unit cells containing rectangular and/or elliptical inclusions. The band-structure, group…

Materials Science · Physics 2014-12-15 Sia Nemat-Nasser

A general method is presented to unfold band structures of first-principles super-cell calculations with proper spectral weight, allowing easier visualization of the electronic structure and the degree of broken translational symmetry. The…

Materials Science · Physics 2010-06-29 Wei Ku , Tom Berlijn , Chi-Cheng Lee

Two-dimensional (2D) honeycomb photonic crystals with cylinders and connecting walls have the potential to have a large full band gap. In experiments, 2D photonic crystals do not have an infinite height, and therefore, we investigate the…

Materials Science · Physics 2015-06-25 Tai-I Weng , G. Y. Guo

Theoretical quest of flat-band tight-binding models usually relies on lattice structures on which electrons reside. Typical examples of candidate lattice structures include the Lieb-type lattices and the line graphs. Meanwhile, there can be…

Materials Science · Physics 2024-11-27 Tomonari Mizoguchi , Mina Maruyama , Yasuhiro Hatsugai , Susumu Okada

This paper presents phononic band-structure calculation results obtained using a mixed variational formulation for 1-, and 2-dimensional unit cells. The formulation itself is presented in a form which is equally applicable to 3-dimensiomal…

Materials Science · Physics 2014-11-13 Ankit Srivastava , Sia Nemat-Nasser
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