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#1 2023-08-08 22:04:16
- rishu
- Member
- Registered: 2020-10-03
- Posts: 23
OpenMolcas not creating .h5 files
Hi
I recently installed OpenMolcas but it is not generating .h5 files.
1. Using cmake, results in an error ("No rule to make target `External/GlobalArrays_install/lib/libga.a', needed by `bin/alaska.exe'. Stop.") And we couldn't find out how to get this resolved other than using configure-cmake.
2. However, using configure-cmake, we don't see an option how to specify hdf5 directories and this leads to h5 files are not generated.
Could you please let me know what we are missing?
Best
Rishu
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#2 2023-08-12 09:58:51
- jxzou
- Member
- Registered: 2020-09-11
- Posts: 7
Re: OpenMolcas not creating .h5 files
I'm afraid that cmake is not the problem. Did you install HDF5 before installing OpenMolcas? Maybe my installation tutorial will do some help, see
OpenMP version: https://gitlab.com/jxzou/qcinstall/-/bl … type=heads
MPI version: https://gitlab.com/jxzou/qcinstall/-/bl … type=heads
Last edited by jxzou (2023-08-12 15:04:29)
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