[Pw_forum] iotk_write_begin

[Andrea Ferretti]

> Hi, everyone,
> Can somebody explain this error in espresso.3.2 pw.x (IBM AIX) at the end of
> job, it seems to be related to the "save" process
> 
> #############################################################
> # UNRECOVERABLE ERROR (ierr=1)
> # ERROR IN: iotk_write_begin (iotk_write.spp:65)
> # CVS Revision: 1.2
> # Wrong tag name
> name=Be+_MASS
> # ERROR IN: iotk_write_dat (iotk_dat.spp:234)
> # CVS Revision: 1.3


The "+" character is not allowed in tag names of iotk (but probably 
this is taken from xml standard)...

basically, you should define the name atomic type "Be+" in a different 
way...

the list of allowed chars (more or less all of them except "+" and few 
others), is defined in 

iotk/srciotk_base.f90    

variable: iotk_namchar
around lines 110-130

cheers
Andrea

--
Andrea Ferretti
National Research Center S3, CNR-INFM  ( http://s3.infm.it )
Dipartimento di Fisica, Universita' di Modena e Reggio Emilia
Via Campi 213/A I-41100 Modena, Italy
Tel:     +39 059 2055301
Fax:     +39 059 374794
Skype:   andrea_ferretti
E-mail:  ferretti.andrea at unimore.it
URL:     http://www.nanoscience.unimo.it

Please, if possible, don't send me MS Word or PowerPoint attachments
Why? See:  http://www.gnu.org/philosophy/no-word-attachments.html