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

Duncan Riley D.J.Riley at salford.ac.uk
Thu Apr 22 09:14:41 CEST 2010


Hi

Has anyone been able compile dftb+ 1.1 using gfortran? If so which version?
When I try I get:

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

Thanks

Duncan

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Dr Duncan Riley
Materials and Physics Research Centre
Maxwell Building
University of Salford
+44 161 2953845




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