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We present an implementation of the GW approximation for the electronic self-energy within the full-potential linearized augmented-plane-wave (FLAPW) method. The algorithm uses an all-electron mixed product basis for the representation of…

Materials Science · Physics 2010-11-15 Christoph Friedrich , Stefan Blügel , Arno Schindlmayr

Optimizing solution-processed organic solar cells is a complex task due to the vast parameter space in organic photovoltaics (OPV). Classical Edisonian or one-variable-at-a-time (OVAT) optimization approaches are laborious, time-consuming,…

We report a systematic analysis of the performance of a widely used set of Dirac-Fock pseudopotentials for quantum Monte Carlo (QMC) calculations. We study each atom in the periodic table from hydrogen (Z=1) to mercury (Z=80), with the…

Materials Science · Physics 2016-10-28 N. D. Drummond , J. R. Trail , R. J. Needs

We propose a novel algorithm for offline reinforcement learning called Value Iteration with Perturbed Rewards (VIPeR), which amalgamates the pessimism principle with random perturbations of the value function. Most current offline RL…

Machine Learning · Computer Science 2023-03-07 Thanh Nguyen-Tang , Raman Arora

We present a method to perform fully selfconsistent density-functional calculations, which scales linearly with the system size and which is well suited for very large systems. It uses strictly localized pseudoatomic orbitals as basis…

Condensed Matter · Physics 2009-10-28 Pablo Ordejon , Emilio Artacho , Jose M. Soler

Genetic Algorithm (GA) has been used in this paper for a new Nyquist based sub-optimal model reduction and optimal time domain tuning of PID and fractional order (FO) PI{\lambda}D{\mu} controllers. Comparative studies show that the new…

Systems and Control · Computer Science 2012-02-28 Saptarshi Das , Indranil Pan , Shantanu Das , Amitava Gupta

A streaming algorithm to compute the spectral proper orthogonal decomposition (SPOD) of stationary random processes is presented. As new data becomes available, an incremental update of the truncated eigenbasis of the estimated…

Fluid Dynamics · Physics 2019-01-14 Oliver T. Schmidt , Aaron Towne

In this thesis, a new approach for constructing subdivision algorithms for generalized quadratic and cubic B-spline subdivision for subdivision surfaces and volumes is presented. First, a catalog of quality criteria for these subdivision…

Computational Geometry · Computer Science 2025-07-29 Alexander Dietz

We use an all-electron implementation of the GW approximation to analyze several possible sources of error in the theory and its implementation. Among these are convergence in the polarization and Green's functions, the dependence of QP…

Materials Science · Physics 2013-05-29 M. van Schilfgaarde , T. Kotani , S. Faleev

This paper proposes a "quasi-synchronous" design approach for signal processing circuits, in which timing violations are permitted, but without the need for a hardware compensation mechanism. The case of a low-density parity-check (LDPC)…

Information Theory · Computer Science 2017-11-21 François Leduc-Primeau , Frank R. Kschischang , Warren J. Gross

Phase noise correction is crucial to exploit full advantage of orthogonal frequency division multiplexing (OFDM) in modern high-data-rate communications. OFDM channel estimation with simultaneous phase noise compensation has therefore drawn…

Information Theory · Computer Science 2017-04-25 Zhongju Wang , Prabhu Babu , Daniel P. Palomar

We describe a new method for the automated construction of one-loop amplitudes based on the open-loop algorithm, where various operations are performed on-the-fly while constructing the integrand. In particular, an on-the-fly reduction…

High Energy Physics - Phenomenology · Physics 2018-01-12 Federico Buccioni , Stefano Pozzorini , Max Zoller

This paper presents reduced-rank linearly constrained minimum variance (LCMV) beamforming algorithms based on joint iterative optimization of filters. The proposed reduced-rank scheme is based on a constrained joint iterative optimization…

Other Computer Science · Computer Science 2012-05-22 R. C. de Lamare , L. Wang , R. Fa

The generation of optical pulses at ultra low bias level, thus low energy cost, is explored in a commercial microcavity semiconductor laser in view of testing the principle of energy efficient information encoding in potential integrated…

Optics · Physics 2019-03-27 Tao Wang , Gaofeng Wang , Gian Piero Puccioni , Gian Luca Lippi

We develop a robust method to extract the pole configuration of a given partial-wave amplitude. In our approach, a deep neural network is constructed where the statistical errors of the experimental data are taken into account. The teaching…

High Energy Physics - Phenomenology · Physics 2021-08-09 Denny Lane B. Sombillo , Yoichi Ikeda , Toru Sato , Atsushi Hosaka

The partial transmit sequence (PTS) technique has received much attention in reducing the high peak to average power ratio (PAPR) of orthogonal frequency division multiplexing (OFDM) signals. However, the PTS technique requires an…

Signal Processing · Electrical Eng. & Systems 2020-03-18 Yajun Wang , Wen Chen , Chintha Tellambura

Differential orthogonal frequency division multiplexing (OFDM) is practically attractive for underwater acoustic communications since it has the potential to obviate channel estimation. However, similar to coherent OFDM, it may suffer from…

Information Theory · Computer Science 2017-11-15 Jing Han , Lingling Zhang , Qunfei Zhang , Geert Leus

We present a zero-range pseudopotential applicable for all partial wave interactions between neutral atoms. For p- and d-waves we derive effective pseudopotentials, which are useful for problems involving anisotropic external potentials.…

Quantum Physics · Physics 2009-11-11 Zbigniew Idziaszek , Tommaso Calarco

As widely used electrochemical storage devices, supercapacitors deliver higher power density than batteries, but suffer from significantly lower energy density. In this work, we propose a topology optimization model for electrode structure…

Optimization and Control · Mathematics 2025-11-27 Jiajie Li , Xiang Ji , Shenggao Zhou , Shengfeng Zhu

This paper presents a machine learning-accelerated optimization framework for RF power amplifier design that reduces simulation requirements by 65% while maintaining $\pm0.4$ dBm accuracy for the majority of the modes. The proposed method…

Machine Learning · Computer Science 2025-07-21 Abhishek Sriram , Neal Tuffy