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The energy minimization involved in density functional calculations of electronic systems can be carried out using an exponential transformation that preserves the orthonormality of the orbitals. The energy of the system is then represented…

Computational Physics · Physics 2022-11-09 Aleksei V. Ivanov , Elvar Ö. Jónsson , Tejs Vegge , Hannes Jónsson

With high-performance computing systems now running at exascale, optimizing power-scaling management and resource utilization has become more critical than ever. This paper explores runtime power-capping optimizations that leverage…

Distributed, Parallel, and Cluster Computing · Computer Science 2025-06-26 Maria Patrou , Thomas Wang , Wael Elwasif , Markus Eisenbach , Ross Miller , William Godoy , Oscar Hernandez

We study the Landau-Lifshitz-Gilbert equation for the dynamics of a magnetic vortex system. We present a PDE-based method for proving vortex dynamics that does not rely on strong well-preparedness of the initial data and allows for…

Analysis of PDEs · Mathematics 2012-03-21 Matthias Kurzke , Christof Melcher , Roger Moser , Daniel Spirn

Multiplication is a core operation in modern neural network (NN) computations, contributing significantly to energy consumption. The linear-complexity multiplication (L-Mul) algorithm is specifically proposed as an approximate…

Hardware Architecture · Computer Science 2024-12-30 Ruiqi Chen , Yangxintong Lyu , Han Bao , Bruno da Silva

The ultra-fast magnetisation relaxation rates during the laser-induced magnetisation process are analyzed in terms of the Landau-Lifshitz-Bloch (LLB) equation for different values of spin $S$. The LLB equation is equivalent in the limit $S…

Materials Science · Physics 2015-05-20 U. Atxitia , O. Chubykalo-Fesenko

A fast algorithm for the approximation of a low rank LU decomposition is presented. In order to achieve a low complexity, the algorithm uses sparse random projections combined with FFT-based random projections. The asymptotic approximation…

Numerical Analysis · Mathematics 2016-01-19 Yariv Aizenbud , Gil Shabat , Amir Averbuch

We make progress towards a 3D finite-element model for the magnetization of a high temperature superconductor (HTS): We suggest a method that takes into account demagnetisation effects and flux creep, while it neglects the effects…

We develop LREI (Low-Rank Eigenmode Integration), a memory- and time-efficient scheme for solving quantum Landau-Lifshitz (q-LL) and quantum Landau-Lifshitz-Gilbert (q-LLG) equations, which govern spin dynamics in open quantum systems.…

Quantum Physics · Physics 2025-09-01 Davoud Mirzaei , Behnam Hashemi , Vahid Azimi-Mousolou

In this paper, the coupled fractional Ginzburg-Landau equations are first time investigated numerically. A linearized implicit finite difference scheme is proposed. The scheme involves three time levels, is unconditionally stable and…

Numerical Analysis · Mathematics 2018-06-01 Dongdong He , Kejia Pan

We develop an energy-decreasing algorithm for the finite element approximation of two-dimensional ferronematic equilibrium states. The problem is formulated as the minimization of the harmonic energy of two two-dimensional vector fields,…

Numerical Analysis · Mathematics 2026-05-13 Alexandre Ern , Ruma R. Maity

We consider the harmonic map heat flow problem for a corotational case. For discretization of this problem we apply a $H^1$-conforming finite element method in space combined with a semi-implicit Euler time stepping. The semi-implicit Euler…

Numerical Analysis · Mathematics 2026-04-22 Nam Anh Nguyen , Arnold Reusken

We propose a finite-difference algorithm for solving the time-dependent Ginzburg-Landau (TDGL) equation coupled to the appropriate Maxwell equation. The time derivatives are discretized using a second order semi-implicit scheme which, for…

Superconductivity · Physics 2009-11-07 T. Winiecki , C. S. Adams

High Energy Physics experiments like the LUX-ZEPLIN dark matter experiment face unique challenges when running their computation on High Performance Computing resources. In this paper, we describe some strategies to optimize memory usage of…

Computational Physics · Physics 2020-12-08 Venkitesh Ayyar , Wahid Bhimji , Maria Elena Monzani , Andrew Naylor , Simon Patton , Craig E. Tull

Energy saving is becoming an important issue in the design and use of computer networks. In this work we propose a problem that considers the use of rate adaptation as the energy saving strategy in networks. The problem is modeled as an…

Networking and Internet Architecture · Computer Science 2013-02-04 Lin Wang , Antonio Fernández Anta , Fa Zhang , Chenying Hou , Zhiyong Liu

Landauer's Principle states that the energy cost of information processing must exceed the product of the temperature and the change in Shannon entropy of the information-bearing degrees of freedom. However, this lower bound is achievable…

Statistical Mechanics · Physics 2019-01-01 A. B. Boyd , A. Patra , C. Jarzynski , J. P. Crutchfield

We solve the Hubbard model with the exact diagonalization method on a graphics processing unit (GPU). We benchmark our GPU program against a sequential CPU code by using the Lanczos algorithm to solve the ground state energy in two cases: a…

Computational Physics · Physics 2012-06-20 Topi Siro , Ari Harju

In this work we explore the use of thermodynamic length to improve the performance of experimental protocols. In particular, we implement Landauer erasure on a driven electron level in a semiconductor quantum dot, and compare the standard…

Mesoscale and Nanoscale Physics · Physics 2023-02-03 Matteo Scandi , David Barker , Sebastian Lehmann , Kimberly A. Dick , Ville F. Maisi , Martí Perarnau-Llobet

One of the challenges of high granularity calorimeters, such as that to be built to cover the endcap region in the CMS Phase-2 Upgrade for HL-LHC, is that the large number of channels causes a surge in the computing load when clustering…

Instrumentation and Detectors · Physics 2020-01-29 Marco Rovere , Ziheng Chen , Antonio Di Pilato , Felice Pantaleo , Chris Seez

We present a computationally efficient approach to solve the time-dependent Kohn-Sham equations in real-time using higher-order finite-element spatial discretization, applicable to both pseudopotential and all-electron calculations. To this…

Computational Physics · Physics 2019-10-02 Bikash Kanungo , Vikram Gavini

We study the momentum-based minimization of a diffuse perimeter functional on Euclidean spaces and on graphs with applications to semi-supervised classification tasks in machine learning. While the gradient flow in the task at hand is a…

Analysis of PDEs · Mathematics 2025-06-26 Oluwatosin Akande , Patrick Dondl , Kanan Gupta , Akwum Onwunta , Stephan Wojtowytsch
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