C240 benchmark
Just Got Here
8:34:39 AM PDT - Fri, Aug 17th 2012
Hi,

I have a question regarding the C240 benchmark, in particular the timings reported in the figure in the Benchmark page of NWChem website.

"Timings are per step for the various components": Does "step" here refer to one step during the electronic minimization? Since the input asks for 4 iterations did you take the walltime and divide it by 4? Or is it the sum of the time spent in those 4 iterations, i.e. the walltime, or something else?

Thanks!
Simone


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