[Pw_forum] QE 6 compilation

[Ari P Seitsonen]

Dear Amir,

   You state "scalapack=opnmpi" on the command line and the linker(? Or 
run-time?) complains about "libmkl_blacs_inte...", which I interpret as 
"blacs_intelmpi" - a contradiction.

   Just my wild guess - you can check in 'make.inc' if the correct BLACS 
version is included.

     Greetings,

        apsi

-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-=*=-
   Ari Paavo Seitsonen / Ari.P.Seitsonen at iki.fi / http://www.iki.fi/~apsi/
     Ecole Normale Supérieure (ENS), Département de Chimie, Paris
     Mobile (F) : +33 789 37 24 25    (CH) : +41 79 71 90 935


On Tue, 7 Feb 2017, Mofrad, Amir Mehdi (MU-Student) wrote:

> 
> Dear QE users and developers, 
> 
> 
> I have been trying to compile QE 6.0 on a cluster for a couple of times but not have been successful yet. At first, I was getting
> the PZUNMTR parameter number error that I think I fixed it using 
> 
> ./configure --with-scalapack=openmpi 
> 
> However, in my error file I get the following error that don't know what it is about: 
> 
> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> Image              PC                                                                     Routine            Line        Source
> pw.x               0000000000CC3265                                       Unknown               Unknown  Unknown
> pw.x               0000000000CC0E87                                       Unknown               Unknown  Unknown
> pw.x               0000000000C5B374                                        Unknown               Unknown  Unknown
> pw.x               0000000000C5B186                                        Unknown               Unknown  Unknown
> pw.x               0000000000BE3B46                                        Unknown               Unknown  Unknown
> pw.x               0000000000BEABE0                                       Unknown               Unknown  Unknown
> libc.so.6          00002B1DBD61A250                                      Unknown               Unknown  Unknown
> libmpi.so.20       00002B1DBCCEEFC5                                 Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B1DB9601E09                                  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B1DB960044D                                  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B1DB95F19CC                                 Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B1DB95F1391                                   Unknown               Unknown  Unknown
> pw.x               0000000000838CAB  mp_diag_mp_mp_sta          78  mp_diag.f90
> pw.x               000000000083A2DB  mp_global_mp_mp_s          96  mp_global.f90
> pw.x               000000000040D2B2  MAIN__                     24  pwscf.f90
> pw.x               000000000040D25E                                          Unknown               Unknown  Unknown
> libc.so.6          00002B1DBD606B35                                        Unknown               Unknown  Unknown
> pw.x               000000000040D169                                            Unknown               Unknown  Unknown
> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> Image              PC                Routine            Line        Source
> pw.x               0000000000CC3265                                           Unknown               Unknown  Unknown
> pw.x               0000000000CC0E87                                           Unknown               Unknown  Unknown
> pw.x               0000000000C5B374                                           Unknown               Unknown  Unknown
> pw.x               0000000000C5B186  Unknown               Unknown  Unknown
> pw.x               0000000000BE3B46  Unknown               Unknown  Unknown
> pw.x               0000000000BEABE0  Unknown               Unknown  Unknown
> libc.so.6          00002B514C9CE250  Unknown               Unknown  Unknown
> libmpi.so.20       00002B514C0A2FC5  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B51489B5E09  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B51489B444D  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B51489A59CC  Unknown               Unknown  Unknown
> libmkl_blacs_inte  00002B51489A5391  Unknown               Unknown  Unknown
> pw.x               0000000000838CAB  mp_diag_mp_mp_sta          78  mp_diag.f90
> pw.x               000000000083A2DB  mp_global_mp_mp_s          96  mp_global.f90
> pw.x               000000000040D2B2  MAIN__                     24  pwscf.f90
> pw.x               000000000040D25E  Unknown               Unknown  Unknown
> libc.so.6          00002B514C9BAB35  Unknown               Unknown  Unknown
> pw.x               000000000040D169  Unknown               Unknown  Unknown
> forrtl: severe (174): SIGSEGV, segmentation fault occurred
> Image              PC                Routine            Line        Source
> pw.x               0000000000CC3265  Unknown               Unknown  Unknown
> 
> Any help would be appreciated.
> 
> 
> Best,
> 
> 
> Amir M. Mofrad    
> 
> University of Missouri
> 
> 
>