http://wiki.physik.fu-berlin.de/it/ 2026-04-27T09:27:19+00:00 http://wiki.physik.fu-berlin.de/it/ http://wiki.physik.fu-berlin.de/it/_media/wiki:dokuwiki-128.png text/html 2024-03-19T13:24:48+00:00 Anonymous (anonymous@undisclosed.example.com) http://wiki.physik.fu-berlin.de/it/benchmark:crest?rev=1710854688&do=diff crest benchmarks * Docs: <https://crest-lab.github.io/crest-docs/> * Binary: <https://github.com/crest-lab/crest/releases/download/latest/crest-latest.tar.xz> * Example: <https://crest-lab.github.io/crest-docs/page/examples/example_1.html> * Command: crest struc.xyz --gfn2 --gbsa h2o -T <threads> Hostname Model OS CPU threads wall-time cpu-time speedup xq01 PowerEdge R7525 text/html 2024-07-29T14:58:31+00:00 Anonymous (anonymous@undisclosed.example.com) http://wiki.physik.fu-berlin.de/it/benchmark:lumerical?rev=1722265111&do=diff Lumerical benchmarks * benchmark file: * command: mpirun -n $(nproc) /net/opt/lumerical/${VER}/bin/fdtd-engine-ompi-lcl -t 1 benchmark_small.fsp solver speed result from logfile: grep 'FDTD solver speed on process 0' x001/benchmark_small_p0_v241.log text/html 2023-04-17T23:01:56+00:00 Anonymous (anonymous@undisclosed.example.com) http://wiki.physik.fu-berlin.de/it/benchmark:tinker9?rev=1681772516&do=diff tinker9 benchmarks Hostname OS CPU GPU ns/day mean ns/day stdev CUDA Cores Bandbreite TFLOPS Bandbreite/(ns/day) velox bullseye i9-13900K RTX 6000 Ada 16.45 0.21