scholarly journals Analytical gradients for tensor hyper-contracted MP2 and SOS-MP2 on graphical processing units

2017 ◽  
Vol 147 (16) ◽  
pp. 161723 ◽  
Author(s):  
Chenchen Song ◽  
Todd J. Martínez
Keyword(s):  
Graphical Processing Units ◽  
Graphical Processing ◽  
Analytical Gradients

A practical implementation of acoustic full waveform inversion on graphical processing units

2015 ◽  
Vol 6 (2) ◽  
pp. 5-16 ◽  
Author(s):  
Sergio Alberto Abreo Carrillo ◽  
Ana B. Ramirez ◽  
Oscar Reyes ◽  
David Leonardo Abreo-Carrillo ◽  
Herling González Alvarez
Keyword(s):  
Waveform Inversion ◽  
Practical Implementation ◽  
Full Waveform Inversion ◽  
Full Waveform ◽  
Graphical Processing Units ◽  
Graphical Processing

Using GPUs to compute fast Fourier transforms for crystal structure solution and refinement

2013 ◽  
Vol 46 (3) ◽  
pp. 594-600 ◽  
Author(s):  
ElSayed Mohamed Shalaby ◽  
Miguel Afonso Oliveira
Keyword(s):  
Crystal Structure ◽  
Fourier Transformation ◽  
Fourier Transforms ◽  
Fast Fourier Transformation ◽  
Parallel Calculations ◽  
The Past ◽  
Graphical Processing Units ◽  
Software Algorithms ◽  
Structure Solution ◽  
Graphical Processing

In the past few years, new hardware tools have become available for computing using the graphical processing units (GPUs) present in modern graphics cards. These GPUs allow efficient parallel calculations with a much higher throughput than microprocessors. In this work, fast Fourier transformation calculations used inSIR2011software algorithms have been carried out using the power of the GPU, and the speed of the calculations has been compared with that achieved using normal CPUs.

Efficient implementation of effective core potential integrals and gradients on graphical processing units

2015 ◽  
Vol 143 (1) ◽  
pp. 014114 ◽  
Author(s):  
Chenchen Song ◽  
Lee-Ping Wang ◽  
Torsten Sachse ◽  
Julia Preiß ◽  
Martin Presselt ◽  
...  
Keyword(s):  
Efficient Implementation ◽  
Effective Core Potential ◽  
Core Potential ◽  
Graphical Processing Units ◽  
Graphical Processing

scholarly journals Numerical simulation of 2D electrodynamic problems with unstructured triangular meshes

2019 ◽  
Vol 43 (3) ◽  
pp. 385-390
Author(s):  
D.A. Fadeev
Keyword(s):  
Numerical Simulation ◽  
Cauchy Problem ◽  
Finite Difference ◽  
Numerical Solution ◽  
Time Domain ◽  
Finite Difference Time Domain ◽  
Regular Triangulation ◽  
Graphical Processing Units ◽  
Graphical Processing ◽  
Difference Time

We present a generalization of standard leap-frog plus Yee mesh approach for Cauchy problem in electrodynamics simulations on unstructured triangulated mesh. The presented approach still inherits from finite-difference time-domain and do not use techniques developed in finite-volume time-domain approach. In the paper the whole flow from mesh creation to actual simulation is presented. The proposed computation flow is parallel ready and can be implemented for distributed systems (computation servers, graphical processing units, etc.). We studied the influence of non-regular triangulation on stability and dispersion properties of numerical solution.

Sign in / Sign up

Export Citation Format

Share Document