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I have stumbled upon this while working on the otf backend but it extends to local_smart and lat_int:
If you try to use very long names for processes (may also happen for other of the model components…
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**Originally by _michael michael.bane@manchester.ac.uk_ on 2009-07-13 16:29:19 -0500**
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```
I'm wishing to use -mpe=mpilog for F90 files using mpif90 build use
gfortran but can't find the magic …
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I'm trying to cluster a very large dataset (1.2M frames) with `pyemma.coordinates.cluster_mini_batch_kmeans`, and find that the clustering code eats up all memory over a few hours without ever startin…
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Nevermind - The problem is elsewhere. My bad.
Edit : The problem seems to be there after all...
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I thought I had to use `FORTRAN90` modules. These are like classes in OOP, but they felt like global arrays the way I was using them. This caused a lot of problems.
The solution is to, in the called …
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**Originally by _loc duong ding mambom1902@yahoo.com_ on 2008-11-06 02:31:06 -0600**
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```
Dear,
I use Mpich2 to run Quantum Epresso code. I have a error when I try to run
execute file pw.x.
>>…
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Wall distance computation is SU2 right now seems to be doing brute force search along the wall boundaries to find the nearest wall vertex. One performance optimization here would be to use k-d search…
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Sorry if i don't even make any sense or have not read everything you have published, but i have some ideas , questions , or suggestions for the solver..
So, i have tried a few schemes, they are like …
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Myself and @peterfpeterson have the same problem. Grabbing the 4.4.1-rc2 tarball and building with
`-DENABLE_HDF5=1 -DENABLE_HDF4=1 -DENABLE_MXML=1 -DENABLE_CXX=1 -DENABLE_FORTRAN77=1 -DENABLE_FORTR…
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To use the F77 API the napif.inc file is needed, to use the F90 API the nxmodule.mod and/or nxumodule.mod files must be available.
In the case of .mod files, they are only valid for the same compiler…