Dear aqing,
the thing is that Maacroave do not recognize the VH filetype.
You can modify the source code adding the proper branch in the
if-then-elseif test or simply rename provisionally your bulk_Au.VH as
bulk_Au.VT, run Macroave and then, to avoid future confusions, rename
back it to bulk_Au.VH.
Riccardo
On 11/3/11 9:57 AM, 陈阿青 wrote:
hello,
when I calculate the electrostatic potential, how can I get the dates
from the SystemLabel.VH. I use the code MACROAVE. But there is always a
error as follows:
supercaq@supercaq-ThinkPad-Edge:~/workfunction$ macroave
At line 75 of file ../../../src/01_macroavnew_ext/iorho.F90 (unit = 1,
file = 'bulk_Au.VH')
Fortran runtime error: Format present for UNFORMATTED data transfer
supercaq@supercaq-ThinkPad-Edge:~/workfunction$
what is the problem? can anyone help me ?
Thank you very much !
aqing
--
Riccardo Rurali
Institut de Ciència de Materials de Barcelona (ICMAB)
Consejo Superior de Investigaciones Científicas (CSIC)
Campus de Bellaterra
08193 Bellaterra (Barcelona)
Spain
tel.: +34 93 5801853 ext. 347
e-mail: [email protected]
http://www.icmab.es/dmmis/leem/
Man, the dope's that there's still hope
