On-the-fly clustering for exascale molecular dynamics simulations. - presented by Dr Alizée Dubois and Thierry Carrard

On-the-fly clustering for exascale molecular dynamics simulations.

Alizée Dubois and Thierry Carrard

ADThierry Carrard
Slide at 26:40
3 mars 15:28 a
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pres_algo_killian.pdf
ANALYSIS
nb pores = 0
t = 6.0 ps
X Axis
X Axis
2000
10000
2000
0000
7 Axll 4000
Z Axil
4000
6000
9000
Tantalum
6000
8000
8000
8000
8000
7000
10000
1 x 1 X 0.15 um 3
7000
10000
10000
6000
10000
6000
9000
500g
Axil
9000
5000
Axis
4000
8, 3 B atoms
8000
4000
8000
3000
3000
7000
2000
2000
6000
1000
5, 2 B voxels
1000
5000
Y Axi
5000
4.0e+09
4000
2000
.9e+02
4000
2000
10 Mh
3000
4000
3.9543e+09
3000
4000
2000
2 Akm
6000
2 Axs
3.9542e+09
2000
6000
1000
ROOD
3.9541e+09
32768 cores
8000
X Axis
3 954e+09
580 560
40e+09
5.4e+02
A. DUBOIS - T. CARRARD - COMPUTER PHYSICS COMMUNICATIONS SEMINAR SERIES - 03/03/25
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Summary (AI generated)

In this section, we present an example comparing a Tantalum structure of 1 micron by 1 micron to one measuring 150 nanometers. This represents a significant advancement in our capabilities. We successfully performed connected components analysis and detected all relevant features, which was a highly satisfactory outcome. Additionally, we will discuss the image processing techniques employed in this analysis.