Re: [QE-users] Installing qe-6.3. Install directory PREFIX does not work

2018-07-11 Thread Paolo Giannozzi
Correcting myself: "make install" copies binaries into $PREFIX/bin. If you want to copy something else into $PREFIX/some-other-directory/, you have to modify the Makefile Paolo On Wed, Jul 11, 2018 at 6:47 PM, Paolo Giannozzi wrote: > On Wed, Jul 11, 2018 at 2:51 PM, Dan Gil wrote: > > [...]

Re: [QE-users] Installing qe-6.3. Install directory PREFIX does not work

2018-07-11 Thread Paolo Giannozzi
On Wed, Jul 11, 2018 at 2:51 PM, Dan Gil wrote: [...] the installation takes place in the same directory that the source > files are. I looked at make.inc to see what it says about the PREFIX: > > # Install directory - not currently used > PREFIX = /home/psg30/.usr/local > > How do I use PREFIX

Re: [QE-users] problem compiling qe-6.3

2018-07-11 Thread José Carlos Conesa
Dear Paolo, Indeed this was the problem. I changed the configure options and compilation went OK. Many thanks El 10/07/2018 a las 21:41, Paolo Giannozzi escribió: It looks like a mismatch between Modules/fox_init_module.f90 and FoX. Please verify that you have compiled the sources of FoX that

Re: [QE-users] problem compiling qe-6.3

2018-07-11 Thread Paolo Giannozzi
.. and that FoX was actually compiled! Not sure that "make" stops in case of errors in FoX compilation Paolo On Tue, Jul 10, 2018 at 9:41 PM, Paolo Giannozzi wrote: > It looks like a mismatch between Modules/fox_init_module.f90 and FoX. > Please verify that you have compiled the sources of FoX

Re: [QE-users] Problems to run QE in parallel

2018-07-11 Thread Paolo Giannozzi
On Wed, Jul 11, 2018 at 4:07 PM, Anibal Bezerra < anibal.beze...@unifal-mg.edu.br> wrote: > > Is there anything else I could check for? > > The only thing to be checked for is that the mpi libraries (linked by your compiler) and run-time environment (mpirun, mpiexec, mpiwhatever) are compatible.

Re: [QE-users] Problems to run QE in parallel

2018-07-11 Thread Anibal Bezerra
Dear Paulo, Thanks a lot for the quick response!! Even using the command "mpirun" when I complied QE using Intel's MPI, I got the same output. I've started the compiling and making process from the beginning, after uninstalled Intel's MPI, Mpich, installed Mpich's MPI again re-configured QE.

[QE-users] Installing qe-6.3. Install directory PREFIX does not work

2018-07-11 Thread Dan Gil
Hi, I am installing qe-6.3 on a high performance computer in my personal storage space. I do: ./configure --prefix= /home/psg30/.usr/local and then: make all However, the installation takes place in the same directory that the source files are. I looked at make.inc to see what it says about