thank you very much!
---------------------------------------
Anastassia Alexandrova, Ph.D.
Yale University
Department of Chemistry
225 Prospect Street
New Haven, CT 06520-8107
Phone: 203-432-6288
Fax: 203-432-6144
[EMAIL PROTECTED]
http://zarbi.chem.yale.edu/~anastassia/
---------------------------------------
Go one more mile...
Quoting reza behnam <[EMAIL PROTECTED]>:
Hi Anastassia,
I am sending the file as an attachment to compare.
Cheers,
Reza
----
M. R. Benam
Visiting Professor,
Department of Physics and Astronomy,
University of British Colombia,
Vancouver, Canada.
----- Original Message ----
From: Anastassia Alexandrova <[EMAIL PROTECTED]>
To: [email protected]
Sent: Tuesday, May 13, 2008 12:30:42 PM
Subject: [SIESTA-L] run time error, file m_wxml_text.F90
Dear Siesta Users,
I successfully compiled SIESTA. I try to reproduce the QUICK
START/Running the
program/h2o.fdf example. I follow all the steps: create a pseudopotential
for O, retrieve the pseudopotential for H, run siesta < h2o.fdf | tee h2o.out
It does not work! The error message that it produces is the following:
At line 44 of file m_wxml_text.F90
Fortran runtime error: Nonnegative width required in format
(i*)
^
It does not create all the files that it must create after a successful run
of course.
I then look at the code, file m_wxml_text.F90, line 44:
41: character(len=100) :: s
42: character(len=4) :: form
43: write(form,'(a,i1,a)') '(i',len(s),')'
44: write(s, form) i
It looks like, in line 43, they write to the variable 'form', which is len=4.
But there seems to be too many things that go into it:
'(i', len(s) which is 100, and ')'
I am guessing this is the problem it's having. Could anyone please
look at your
code of SIESTA and tell me what you have in the vicinity of the line
44 in the
file m_wxml_text.F90?
PLEASE help!
Thank you very much.
Best regards,
Anastassia
---------------------------------------
Anastassia Alexandrova, Ph.D.
Yale University
Department of Chemistry
225 Prospect Street
New Haven, CT 06520-8107
Phone: 203-432-6288
Fax: 203-432-6144
[EMAIL PROTECTED]
http://zarbi.chem.yale.edu/~anastassia/
---------------------------------------
Go one more mile...
