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From: Wien [mailto:wien-boun...@zeus.theochem.tuwien.ac.at] On Behalf Of
Peter Blaha
Sent: Tuesday, January 10, 2017 14:01
To: A Mailing list for WIEN2k users <wien@zeus.theochem.tuwien.ac.at>
Subject: Re: [Wien] Broa
Yes, there is a severe bug in broadening.f of WIEN2k_16/SRC_broadening:
The corrected part of the code should look like:
! *** READING THE SPECTRUM
***
! first scan the file to count the header lines :
nimax=0
header=0
Caused by a bug in SRC_broadening/broadening.f?
The read statement on line 163 has status (a CHARACTER *11), but
previous WIEN2k 14.2 had modus (a CHARACTER *4).
On line 164, there is:
if (modus(1:1).eq.'#'.or.modus(2:2).eq.'#'.or.modus.eq.' ')
then
The WIEN2k update page [
Dear WIEN2k users,
An error occurs in x broadening of TELNES3 in WIEN2k_16.1.
The details of the error are as follows.
0 lines1014 lines
forrtl: severe (59): list-directed I/O syntax error, unit 47, file
/net/h86/WIEN2k/STO-test/STO-test.elnes
Image PC
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