input file for Si nanowire, running error
Posted: Tue Jun 10, 2014 4:49 am
Hi all,
Back again with the silicon nanowires. Strange situation, running the nanosi-band001 input file produced the following error:
hdr_check.F90:291:ERROR
fft grids must be the same for restart from a density file.
Action : change your fft grid or your restart file.
-P-0000
-P-0000 leave_new : decision taken to exit ...
hdr_check.F90:291:ERROR
fft grids must be the same for restart from a density file.
Action : change your fft grid or your restart file.
While an almost identical input file running the same calculation does not. What is causing the error and how do I fix it?
Thanks in advance for the help, it is very generous.
Chris
Back again with the silicon nanowires. Strange situation, running the nanosi-band001 input file produced the following error:
hdr_check.F90:291:ERROR
fft grids must be the same for restart from a density file.
Action : change your fft grid or your restart file.
-P-0000
-P-0000 leave_new : decision taken to exit ...
hdr_check.F90:291:ERROR
fft grids must be the same for restart from a density file.
Action : change your fft grid or your restart file.
While an almost identical input file running the same calculation does not. What is causing the error and how do I fix it?
Thanks in advance for the help, it is very generous.
Chris