alan chen wrote: > 1) I have a few jobs running at the same time. Unfortunately they have > the same 'prefix' so that these xxx.igk files may overwrite each other. > Does that matter? Does the code read in these files?
if you have more than one k-point, it reads them during self-consistency. Otherwise, at the end, but only when collecting wavefunctions, IIRC. In any case, you should never run two jobs in the same scratch directory with the same file names. > 2) Recently when I calculate large jobs, I got the following error > message: 'input statement requires too much data, unit 16, file > /home1/hc336/scratch/IF-relax.igk19'. it looks like one process is trying to read data overwritten by another process. Not good. Paolo -- Paolo Giannozzi, Democritos and University of Udine, Italy
