0:0:movecs write: ma failed


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Just Got Here
Hello everybody!

I guess, my problem is a well known one. However, I cannot find any solution in the forum until now. I am trying to benchmark various basis sets and when I use larger ones like aug-cc-pvtz I get the following error message:

0:0:movecs_write: ma failed:: 6450
(rank:0 hostname:i15r07a08 pid:21353):ARMCI DASSERT fail. ../../ga-5-3/armci/src/common/armci.c:ARMCI_Error():208 cond:0

So, instead of writing the movecs file, the calculation stops. I have the doubt that the file would be too large and therefore it is not printed since my structure is quite large (c60 with another molecule on top of it).

Thank you for you help!

Ciao

Janna