#GAUSSIAN SOFTWARE CPU GPU BENCHMARK MANUAL#

NO commercial development or application in software being developed forД¬ommercial release is permitted. IMPORTANT NOTE: The licensing agreement with Gaussian allows for the use of this program ONLY forДЄcademic research purposes and only for research done in association with the University The user's guide is also available online at the Gaussian web site.

#GAUSSIAN SOFTWARE CPU GPU BENCHMARK MANUAL#

A user's guide and a programmer's reference manual are available from Gaussian and Please direct questions regarding Gaussian to the Gaussian developers. In the gaussian16 slurm batch script provided (see below). Therefore it is best if you use the optimum version. AVX2 - version for 24 and 28 core nodes on kingspeak and ash notchpeak nodesДЄs the newer processors have the older instruction set, these are backwards compatible,В i.e., theВ SSE4 and legacyВ will run all all nodes on the CHPC clusters, but the performance is impacted and the runs.AVX - version for all tangent nodes 16 and 20 core nodes on kingspeak and ash.SSE4В - version for lonepeak nodes 12 core nodes on ash.

Needed applicable any of the CHPC resources) legacyВ for when none of the instruction sets listedВ below are available (no longer.To the presence of the SSE4, AVX, or AVX2 instructionВ sets. Note that are four different executable directories in this location - corresponding Location of latest revision: /uufs//sys/installdir/gaussian16/C01.Current revision:В C.01 (previous versionsВ of B.01 andВ A.03 still exist).Gaussian 16В is the newest version of the Gaussian quantum chemistry package, replacing University Application Heath Summary - NOC.Narwhal User Guide (Protected Environment Statistics).

Gaussian software cpu gpu benchmark