[DFTB-Plus-User] DFTB+ 1.1 release candidate

Bálint Aradi balint.aradi at bccms.uni-bremen.de
Thu Apr 22 10:21:29 CEST 2010


Dear Duncan,

> gfortran -O2 -openmp -funroll-all-loops -fall-intrinsics -o m_dom_node.o -c
> /home/duncan/Downloads/dftb+_1.1rc1_src/prg_dftb/../ext_xmlf90/m_dom_node.f9
> 0
> /home/duncan/Downloads/dftb+_1.1rc1_src/prg_dftb/../ext_xmlf90/m_dom_node.f9
> 0:56.25:
> 
>     value_len = len_trim(node % nodeValue)
>                         1
> Error: Procedure argument at (1) is local to a PURE procedure and has the
> POINTER attribute
> /home/duncan/Downloads/dftb+_1.1rc1_src/prg_dftb/../ext_xmlf90/m_dom_node.f9
> 0:48.24:
> 
>     name_len = len_trim(node % nodeName)
>                        1
> Error: Procedure argument at (1) is local to a PURE procedure and has the
> POINTER attribute
> make[1]: *** [m_dom_node.o] Error 1


 It is a bug of gfortran 4.3, which was fixed in the 4.4 release, after
we reported it:

http://www.mail-archive.com/gcc-bugs@gcc.gnu.org/msg225538.html

 As stated in the release notes of DFTB+ 1.1:

http://www.dftb-plus.info/about_dftb/release_11/

  you should be able to compile the code with gfortran 4.4.1.


  Best regards

  Bálint

-- 
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/en/~b_aradi


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