[Pw_forum] Does SOC conflict with HSE06?

[lilonghua]

Dear Paolo Giannozzi,

The error message is about MPI: 
"Fatal error in PMPI_Barrier: Other MPI error, error stack:
PMPI_Barrier(363).................: MPI_Barrier(comm=0x84000005) failed
MPIR_Barrier_impl(251)............: 
MPIR_Bcast_impl(1150).............: 
..."

some contents of output file are listed as following:
"...
 ...
 Self-consistent Calculation

     iteration #  1     ecut=    35.00 Ry     beta=0.50
     Davidson diagonalization with overlap
     ethr =  1.00E-02,  avg # of iterations =  6.6
...
...
     iteration #  3     ecut=    35.00 Ry     beta=0.50
     Davidson diagonalization with overlap
     ethr =  7.20E-05,  avg # of iterations =  3.3

     total cpu time spent up to now is       50.1 secs

     End of self-consistent calculation

        k = 0.7071 0.0000 0.0000 (  1588 PWs)   bands (ev):
        ...
        ...
        k = 0.0000 0.0000 0.0000 (  1639 PWs)   bands (ev):

    -7.0743  -7.0743  -0.6100  -0.6100   2.8041   2.8041   3.9266   3.9266
     3.9266   3.9266   7.5157   7.5157   9.6413   9.6413   9.6413   9.6413
    10.7299  10.7340  10.8087  10.8418

     highest occupied, lowest unoccupied level (ev):     4.8845    4.9068 "

ok! ---this is the end of output file. in normal condition, it will print exx information, but in my case (hse+soc), it stops at the end of scf. 

2011-08-30 
lilonghua
foursea at 163.com