[Pw_forum] Problem when compile Quantum espresso (CVS)

loc duong ding mambom1902 at yahoo.com
Tue Jun 9 08:03:40 CEST 2009


 Dear developers and users,
 
I complie QE (CVS version) with my PC with Ferdora linux and Cywin without any problem. 
However, when I try to complie with my cluster (Centos, i686-pc-linux-gnu, 
architecture ia32), I have a problem. The error message is:
 

In file casino2upf.f90:98 
      REAL*8, ALLOCATABLE :: wavefunc(:)
                       1
 Error: Attribute at (1) is not allowed in a TYPE definition
  In file casino2upf.f90:304
         IF ( ALLOCATED(mtail%wavefunc) ) THEN
                                     1
 Error: 'wavefunc' at (1) is not a member of the 'wavfun_list' structure
  In file casino2upf.f90:308
            ALLOCATE( mtail%wavefunc(mesh_) )
                                   1
 Error: 'wavefunc' at (1) is not a member of the 'wavfun_list' structure
  In file casino2upf.f90:309
         ELSE
            1
 Error: Unexpected ELSE statement at (1)
  In file casino2upf.f90:310
            ALLOCATE( mtail%wavefunc(mesh_) )
                                   1
 Error: 'wavefunc' at (1) is not a member of the 'wavfun_list' structure
  In file casino2upf.f90:311
         END IF
           1
 Error: Expecting END DO statement at (1)
  In file casino2upf.f90:317
         READ(j, *, err=300) (mtail%wavefunc(ir),ir=1,mesh_)
                           1
 Error: Expected variable in READ statement at (1)
  In file casino2upf.f90:352
         chi_(ir:,i) = mptr%wavefunc(ir)
                                   1
 Error: 'wavefunc' at (1) is not a member of the 'wavfun_list' structure
  In file casino2upf.f90:354
      deallocate( mptr%wavefunc )
                              1
 Error: 'wavefunc' at (1) is not a member of the 'wavfun_list' structure
 make[1]: *** [casino2upf.o] Error 1
 make[1]: Leaving directory `/home/loc/espresso/upftools'
 make: *** [upf] Error 2
 
I don't know where this error come from. Could you give me some instructions for 
solving this error? I am running QE4.0 in this cluster.
 
Sincerely, 

Loc Duong Dinh
Ms-Ph.D Student
Sungkyunkwan Advanced Institute of Nanotechnology,
Sungkyunkwan University,
Suwon, 440-746, Korea 
Email: mambom1902 at yahoo.com  



      



More information about the users mailing list