Poster (After Call) FZJ-2026-02006

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Build and Benchmark Automation of libNEGF



2026

6th Conference for Research Software Engineering in Germany, deRSE26, StuttgartStuttgart, Germany, 3 Mar 2026 - 5 Mar 20262026-03-032026-03-05 [10.34734/FZJ-2026-02006]

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Abstract: libNEGF is a quantum transport code being upgraded to simulate complex quantum mechanics processes on state-of-the-art HPC machines. The poster highlights bugs and performance issues found with the aid of the continuous integration (CI) and continuous benchmarking (CB) pipelines.


Note: In the paragraph titled "Diagnosing Bugs with More Runs", the expected data on the plots should be a constant current. In the paragraph titled "Continuous Benchmarking", the crosses in the plot refer to elapsed time (left axis) and the circles refer to consumed energy (right axis).

Contributing Institute(s):
  1. Jülich Supercomputing Center (JSC)
Research Program(s):
  1. 5111 - Domain-Specific Simulation & Data Life Cycle Labs (SDLs) and Research Groups (POF4-511) (POF4-511)
  2. Simulation and Data Laboratory Quantum Materials (SDLQM) (SDLQM) (SDLQM)
  3. EoCoE-III - Energy oriented Center of Excellence (101143931_16HPC102K) (101143931_16HPC102K)

Appears in the scientific report 2026
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 Record created 2026-03-10, last modified 2026-07-11


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