runtime error at line 553 of file mlwf.f90
Posted: Thu Jul 18, 2013 5:14 pm
Dear admin,
I'd like to wannierize my vasp5.2.12 calculation.
I properly installed Vasp with the flag -DVASP2WANNIER90
and accordingly I added the wannier libs.
When I add the LWANNIER90 = .TRUE. to the INCAR file, after the usual sfc loop, there is this runtime error:
The same occurs with parallel and the serial version or with "standard" example found at:
http://cms.mpi.univie.ac.at/wiki/index. ... WANNIER90)
More over, if a good wannier90.win is provided, there are no problems.
any suggestion?
best regards
alistar
I'd like to wannierize my vasp5.2.12 calculation.
I properly installed Vasp with the flag -DVASP2WANNIER90
and accordingly I added the wannier libs.
When I add the LWANNIER90 = .TRUE. to the INCAR file, after the usual sfc loop, there is this runtime error:
Code: Select all
?At?line?553?of?file?mlwf.f90?(unit?=?99,?file?=?'wannier90.win')?
Fortran?runtime?error:?Sequential?READ?or?WRITE?not?allowed?after?EOF?marker,?possibly?
use?REWIND?or?BACKSPACEThe same occurs with parallel and the serial version or with "standard" example found at:
http://cms.mpi.univie.ac.at/wiki/index. ... WANNIER90)
More over, if a good wannier90.win is provided, there are no problems.
any suggestion?
best regards
alistar