Re: [Pw_forum] QE 6.0 compilation problem

2017-03-09 Thread Michel Marcondes
Hello Arles, I had the same problem compiling espresso with intel fortran 2016, and I solved the problem compiling with parallel studio 2015 update 6. Best regards, Michel Marcondes Physicist University of São Paulo http://lattes.cnpq.br/9541158390223884 > On Mar 9, 2017, at 06:23, Paolo

Re: [Pw_forum] QE 6.0 compilation problem

2017-03-08 Thread Bramha Pandey
Dear Arles, I can see few points.. the command you are using >> mpirun -np 1 pw.in -in scf.in it might be for more than 1 processor.. >> mpirun -np 2 pw.x -inp scf.in let try above command. Hope it will help. -- Regards Dr. Bramha P Pandey Asstt. Prof. ECE Deptt. GLA University, Mathura (U.P)

[Pw_forum] QE 6.0 compilation problem

2017-03-08 Thread Arles V. Gil Rebaza
Dear QE user, i've compiled QE 6.0 using fortran intel 2016 on i7 computer with ubuntu 16 . The compilation finished fine using, ./configure --enable-parallel --with-scalapack=intel when i try to run >> mpirun -np 1 pw.in -in scf.in the calculation finish ok, but when i increase -np 2 (o more)