10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-09-27 12:00:56 +02:00
quantum_package/docs/source/benchmarks.rst

13 lines
348 B
ReStructuredText
Raw Normal View History

Parallel efficiency
===================
The determinant selection, MR-PT2 and diagonalization are parallelized with distributed parallelism.
Benchmarks for the [NH2-CH-NH2]+ molecule are presented with up to 200 nodes (9600 cores) on the
`Irene` supercomputer.
.. _Irene: http://www-hpc.cea.fr/en/complexe/tgcc-Irene.htm
2018-10-19 18:19:24 +02:00
.. include:: work.rst