5,071 research outputs found
Beamforming Techniques for Large-N Aperture Arrays
Beamforming is central to the processing function of all phased arrays and
becomes particularly challenging with a large number of antenna element (e.g.
>100,000). The ability to beamform efficiently with reasonable power
requirements is discussed in this paper. Whilst the most appropriate
beamforming technology will change over time due to semiconductor and
processing developments, we present a hierarchical structure which is
technology agnostic and describe both Radio-Frequency (RF) and digital
hierarchical beamforming approaches. We present implementations of both RF and
digital beamforming systems on two antenna array demonstrators, namely the
Electronic Multi Beam Radio Astronomy ConcEpt (EMBRACE) and the
dualpolarisation all-digital array (2-PAD). This paper will compare and
contrast both digital and analogue implementations without considering the deep
system design of these arrays.Comment: 8 pages, Accepted IEEE Phased Array 201
Low-energy tetrahedral polymorphs of carbon, silicon, and germanium
Searches for low-energy tetrahedral polymorphs of carbon and silicon have
been performed using density functional theory computations and the ab initio
random structure searching (AIRSS) ap- proach. Several of the hypothetical
phases obtained in our searches have enthalpies that are lower or comparable to
those of other polymorphs of group 14 elements that have either been
experimentally synthesized or recently proposed as the structure of unknown
phases obtained in experiments, and should thus be considered as particularly
interesting candidates. A structure of P bam symmetry with 24 atoms in the unit
cell was found to be a low energy, low-density metastable polymorph in carbon,
silicon, and germanium. In silicon, Pbam is found to have a direct band gap at
the zone center with an estimated value of 1.4 eV, which suggests applications
as a photovoltaic material. We have also found a low-energy chiral framework
structure of P 41 21 2 symmetry with 20 atoms per cell containing fivefold
spirals of atoms, whose projected topology is that of the so-called Cairo-type
two- dimensional pentagonal tiling. We suggest that P41 21 2 is a likely
candidate for the structure of the unknown phase XIII of silicon. We discuss
Pbam and P41 21 2 in detail, contrasting their energetics and structures with
those of other group 14 elements, particularly the recently proposed P42 /ncm
structure, for which we also provide a detailed interpretation as a network of
tilted diamond-like tetrahedra.AM acknowledges the financial support of the Ministerio
de Educaci´on, Cultura y Deporte (MECD, Spain)
through its Programa de Movilidad de Recursos Humanos
(Plan Nacional de I+D+i), grant PRX12/00335,
and of project MAT2010-21270-C04-03. Access to
the MALTA computer cluster (Universidad de Oviedo,
Project CSD2007-00045) and the High Performance
Computing Service of the University of Cambridge are
gratefully acknowledged. RJN and CJP were supported
by the Engineering and Physical Sciences Research Council
(EPSRC) of the UK.We thank Keith Refson for useful
discussions.This is the author accepted manuscript. The final version is available from APS at http://journals.aps.org/prb/abstract/10.1103/PhysRevB.91.214104
Modelling the structure of Zr-rich Pb(Zr1-xTix)O-3, x=0.4 by a multiphase approach
Solid solution perovskite Pb(Zr1−xTix)O3 (PZT) is an industrially important material. Despite the long history of experimental and theoretical studies, the structure of this material is still under intensive discussion. In this work, we have applied structure searching coupled with density functional theory methods to provide a multiphase description of this material at x = 0.4. We demonstrate that the permutational freedom of B-site cations leads to the stabilisation of a variety of local phases reflecting a relatively flat energy landscape of PZT. Using a set of predicted local phases we reproduce the experimental pair distribution function (PDF) profile with high accuracy. We introduce a complex multiphase picture of the structure of PZT and show that additional monoclinic and rhombohedral phases account for a better description of the experimental PDF profile. We propose that such a multiphase picture reflects the entropy reached in the sample during the preparation process
Crystal Structure of the ZrO Phase at Zirconium/Zirconium Oxide Interfaces
Zirconium-based alloys are used in water-cooled nuclear reactors for both nuclear fuel cladding and structural components. Under this harsh environment, the main factor limiting the service life of zirconium cladding, and hence fuel burn-up efficiency, is water corrosion. This oxidation process has recently been linked to the presence of a sub-oxide phase with well-defined composition but unknown structure at the metal–oxide interface. In this paper, the combination of first-principles materials modeling and high-resolution electron microscopy is used to identify the structure of this sub-oxide phase, bringing us a step closer to developing strategies to mitigate aqueous oxidation in Zr alloys and prolong the operational lifetime of commercial fuel cladding alloys
An efficient k.p method for calculation of total energy and electronic density of states
An efficient method for calculating the electronic structure in large systems
with a fully converged BZ sampling is presented. The method is based on a
k.p-like approximation developed in the framework of the density functional
perturbation theory. The reliability and efficiency of the method are
demostrated in test calculations on Ar and Si supercells
Ab Initio Quality NMR Parameters in Solid-State Materials Using a High-Dimensional Neural-Network Representation.
Nuclear magnetic resonance (NMR) spectroscopy is one of the most powerful experimental tools to probe the local atomic order of a wide range of solid-state compounds. However, due to the complexity of the related spectra, in particular for amorphous materials, their interpretation in terms of structural information is often challenging. These difficulties can be overcome by combining molecular dynamics simulations to generate realistic structural models with an ab initio evaluation of the corresponding chemical shift and quadrupolar coupling tensors. However, due to computational constraints, this approach is limited to relatively small system sizes which, for amorphous materials, prevents an adequate statistical sampling of the distribution of the local environments that is required to quantitatively describe the system. In this work, we present an approach to efficiently and accurately predict the NMR parameters of very large systems. This is achieved by using a high-dimensional neural-network representation of NMR parameters that are calculated using an ab initio formalism. To illustrate the potential of this approach, we applied this neural-network NMR (NN-NMR) method on the (17)O and (29)Si quadrupolar coupling and chemical shift parameters of various crystalline silica polymorphs and silica glasses. This approach is, in principal, general and has the potential to be applied to predict the NMR properties of various materials.This is the author accepted manuscript. The final version is available from ACS via http://dx.doi.org/10.1021/acs.jctc.5b0100
Electron spectroscopy of carbon materials: Experiment and theory
We present a comparative spectroscopic study of carbon as graphite, diamond and C60 using C1s K-edge electron energy-loss spectroscopy (EELS), X-ray emission spectroscopy, and theoretical modelling. The first principles calculations of these spectra are obtained in the local density approximation using a self-consistent Gaussian basis pseudo-potential method. Calculated spectra show excellent agreement with experiment and are able to discriminate not only between various carbon hybridisations but also local variation in environment. Core-hole effects on the calculated spectra are also investigated. For the first time, the EEL spectrum of carbyne is calculated
The 2015 superoutburst of QZ Virginis: Detection of growing superhumps between the precursor and main superoutburst
We report on time-resolved photometry of the 2015 February-March
superoutburst of QZ Virginis. The superoutburst consisted of a separated
precursor, main superoutburst, and rebrightening. We detected superhumps with a
period of 0.061181(42) d between the precursor and main superoutburst. Based on
analyses of period changes and amplitudes of superhumps, the observed
superhumps were identified as growing superhumps (stage A superhumps). The
duration of stage A superhumps was about 5 d, unusually long for SU UMa-type
dwarf novae. Using the obtained stage A superhump period, we estimated the mass
ratio of QZ Vir to be 0.108(3). This value suggests that QZ Vir is an SU
UMa-type dwarf nova evolving toward the period minimum. Based on the present
and the previous observations regarding long-lasting stage A superhumps, a time
scale of stage A superhumps is likely to be determined by the mass ratio of the
system and the temperature of the accretion disk.Comment: 12 pages, 6 figures, published for PASJ, 69, 7
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