[QE-users] QE-6.5 with hdf5 library

[Pietro Delugas]

H5fc or h5cc should be in the hdf5/bin directory. The fact that it isn’t usually means that you have compiled hdf5 without the fortran support. You should recompile it with it. 


Sent from Mail for Windows 10

From: rekha sharma
Sent: Wednesday, November 18, 2020 7:37 PM
To: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] QE-6.5 with hdf5 library

Dear Sir
I do not see any  -D__HDF5 in my make.inc
Yes, I have the directory
/home/rekha/soft/hdf5/bin
and in the bin dir I have
gif2h5  h52gif  h5cc  h5clear  h5copy  h5debug  h5diff  h5dump  h5format_convert  h5import  h5jam  h5ls  h5mkgrp  h5perf_serial  h5redeploy  h5repack  h5repart  h5stat  h5unjam  h5watch
I have defined the path of hdf5 in bashrc
export PATH=/home/rekha/soft/hdf5/bin:$PATH

h5fc –show   is not working.

What should I do?



On Wed, Nov 18, 2020 at 11:01 PM rekha sharma <rekha1997jpr at gmail.com> wrote:
Dear Sir
Thank you very much.
Still  I do not see any changes in my make.inc file.

I see  below only
DFLAGS         =  -D__DFTI -D__MPI
How can I know that the QE has been compiled with hdf5 or not?
Thank you

On Wed, Nov 18, 2020 at 10:12 PM rekha sharma <rekha1997jpr at gmail.com> wrote:
Dear Expert Quantum Espresso Users
I wanted to compile QE version 6.5 with hdf5  but I do not see any hdf option make.inc after ./configure option with below options
--with-hdf5-libs=-L/home/rekha/soft/hdf5/lib --with-hdf5-include=/home/rekha/soft/hdf5/include

Can you please tell me how to install qe-6.5 with hdf5?

Thank you very much

-- 




Best wishes

Ms. Rekha
Teaching Assistant,
Department of Physics
RK college, Jaipur, India
Mob.: +11 91-95 790 71 697
Email: rekha1997jpr at gmail.com



-- 




Best wishes

Ms. Rekha
Teaching Assistant,
Department of Physics
RK college, Jaipur, India
Mob.: +11 91-95 790 71 697
Email: rekha1997jpr at gmail.com



-- 




Best wishes

Ms. Rekha
Teaching Assistant,
Department of Physics
RK college, Jaipur, India
Mob.: +11 91-95 790 71 697
Email: rekha1997jpr at gmail.com

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