[Wien] [WIEN] wn-readbakgen.f for XCrySDen
Ulrich Wedig
U.Wedig at fkf.mpg.de
Mon Sep 24 11:49:00 CEST 2018
My previous email was rather misshaped by the mail client. I hope you
can read this one more clearly. Please apologize.
In $WIENROOT/SRC_kgen there is a file wn_readbakgen.f which may be
compiled in order to substitute the corresponding executable in the
XCrySDen distribution ($XCRYSDEN_TOPDIR/bin/wn_readbakgen).
However the file supplied in SRC_kgen leads to compile errors:
lines 110,111
read(line,'(43x,i7,err=111)') nkpt
/error: invalid character in format list/
goto 112
/error: label is not defined/
111 read(line,'(44x,i6)') nkpt ! old format
With the following slight modifications, compilation and execution works:
read(line,'(43x,i7)',err=111) nkpt !/modified line 110//
/ goto 112
111 read(line,'(44x,i6)') nkpt ! old format
112 continue ! /added line/
Best regards,
Ulrich
--
-----------------------------------------------------------------
Dr. Ulrich Wedig Tel. 0711/6891535
Max-Planck-Institut fuer Festkoerperforschung FAX 0711/6891502
Heisenbergstr. 1
70569 Stuttgart U.Wedig at fkf.mpg.de
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