Search results for "reduction"
showing 10 items of 2058 documents
Implementation of analytic gradients for CCSD and EOM-CCSD using Cholesky decomposition of the electron-repulsion integrals and their derivatives: Th…
2019
We present a general formulation of analytic nuclear gradients for the coupled-cluster with single and double substitution (CCSD) and equation-of-motion (EOM) CCSD energies computed using Cholesky decomposition (CD) representations of the electron repulsion integrals. By rewriting the correlated energy and response equations such that the storage of the largest four-index intermediates is eliminated, CD leads to a significant reduction in disk storage requirements, reduced I/O penalties, and an improved parallel performance. CD thus extends the scope of the systems that can be treated by (EOM-)CCSD methods, although analytic gradients in the framework of CD are needed to extend the applicab…
Konishi form factor at three loops in N=4 supersymmetric Yang-Mills theory
2017
We present the first results on the third order corrections to on-shell form factor (FF) of the Konishi operator in $\mathcal{N}=4$ supersymmetric Yang-Mills theory using Feynman diagrammatic approach in modified dimensional reduction ($\overline{DR}$) scheme. We show that it satisfies the KG equation in $\overline{DR}$ scheme while the result obtained in four dimensional helicity (FDH) scheme needs to be suitably modified not only to satisfy the KG equation but also to get the correct ultraviolet (UV) anomalous dimensions. We find that the cusp, soft and collinear anomalous dimensions obtained to third order are same as those of the FF of the half-BPS operator confirming the universality o…
Sound absorption prediction of linear damped acoustic resonators using a lightweight hybrid model
2019
International audience; A lightweight numerical method is developed to predict the sound absorption coefficient of resonators whose cross-section dimensions are significantly larger compared to the viscous and thermal boundary layer’s thicknesses. This method is based on the boundary layer theory and on the perturbations theory. According to the perturbations theory, in acoustical domains with large dimensions, the fluid viscosity and thermal conductivity only affect the boundary layers. The model proposed in this article combines the lossless Helmholtz wave equation derived from a perfect fluid hypothesis, with viscosity and thermal conductivity values of a real fluid to compute the sound …
Reduction to finite dimensions of continuous systems having only a few amplified modes
2008
In the approach of Guckenheimer and Knobloch the amplitudes of trajectories on the unstable manifold 0 are the pivotal quantities. This places a certain restriction on the applicability of this approach, as only neighbourhoods of 0 of the unstable manifold of 0 are accessible, which have a one-to-one projection into their tangent at 0, the linear space spanned by the amplified modes. This restriction may be lifted, using the arc lengths of trajectories instead.
Total-variation methods for gravitational-wave denoising: Performance tests on Advanced LIGO data
2018
We assess total-variation methods to denoise gravitational-wave signals in real noise conditions, by injecting numerical-relativity waveforms from core-collapse supernovae and binary black hole mergers in data from the first observing run of Advanced LIGO. This work is an extension of our previous investigation where only Gaussian noise was used. Since the quality of the results depends on the regularization parameter of the model, we perform an heuristic search for the value that produces the best results. We discuss various approaches for the selection of this parameter, either based on the optimal, mean, or multiple values, and compare the results of the denoising upon these choices. Mor…
Neutron-induced soft errors in advanced Flash memories
2008
Atmospheric neutrons are a known source of Soft Errors (SE), in static and dynamic CMOS memories. This paper shows for the first time that atmospheric neutrons are able to induce SE in Flash memories as well. Detailed experimental results provide an explanation linking the Floating Gate (FG) cell SE rate to the physics of the neutron-matter interaction. The neutron sensitivity is expected to increase with the number of bits per cell and the reduction of the feature size, but the SE issue is within the limit of current ECC capabilities and will remain so in the foreseeable future.
Test of molecular mode coupling theory for general rigid molecules
2000
We report recent progress on the test of mode coupling theory for molecular liquids (MMCT) for molecules of arbitrary shape. The MMCT equations in the long time limit are solved for supercooled water including all molecular degrees of freedom. In contrast to our earlier treatment of water as a linear molecule, we find that the glass-transition temperature ${T}_{c}$ is overestimated by the theory as was found in the case of simple liquids. The nonergodicity parameters are calculated from the ``full'' set of MMCT equations truncated at ${l}_{\mathrm{co}}=2.$ These results are compared (i) with the nonergodicity parameters from MMCT with ${l}_{\mathrm{co}}=2$ in the ``dipole'' approximation ${…
Long Lived Acoustic Vibrational Modes of an Embedded Nanoparticle
2004
Classical continuum elastic calculations show that the acoustic vibrational modes of an embedded nanoparticle can be lightly damped even when the longitudinal plane wave acoustic impedances $Z_o=\rho v_L$ of the nanoparticle and the matrix are the same. It is not necessary for the matrix to be less dense or softer than the nanoparticle in order to have long lived vibrational modes. Continuum boundary conditions do not always accurately reflect the microscropic nature of the interface between nanoparticle and matrix, and a multi-layer model of the interface reveals the possibility of additional reduction of mode damping.
Odd-even staggering in simple models of metal clusters
1994
The odd-even staggering of free-electron metal clusters is studied using several simple models: Noninter-acting electrons in a rectangular box, triaxial harmonic oscillator, and Huckel model. Finite temperature effects are studied using the Monte Carlo method. All the models show qualitatively similar odd-even staggering. In the ground state the HOMO-LUMO gap is larger than the neighbouring energy gaps. The reduction of the odd-even staggering due to exchange and correlation is studied using the local-spin-density approximation.
Monte Carlo Study of Diffusion Noise Reduction in GaAs Operating under Periodic Conditions
2009
The effects of an external correlated source of noise on the intrinsic carrier noise in a low‐doped GaAs bulk, operating under periodic conditions, are investigated. Numerical results confirm that the dynamical response of electrons driven by a high‐frequency periodic electric field receives a benefit by the constructive interplay between the fluctuating field and the intrinsic noise of the system. In particular, in this contribute we show a nonmonotonic behavior of the integrated spectral density, which value critically depends on the correlation time of the external noise source.