[QE-users] BEA+Tin: memory limit

[Victor Volkov]

Good day dear members.

I compiled QE and GIPAW under cygwin on a 64bit with 32GB RAM.
I try to run pw.x for BEA zeolite with a Tin inclusion

C:/cygwin64/qe-7.0/bin/pw.x < BEA.in > BEA.out &

CP2K can do the system very well, unless NMR.

Using QE7,
I run into the memory limit.
(Likely, the issue is well-known: please forgive my delay in QE
understanding).

Would you find few minutes to comment my input,
if it can be more spartan to try the task,
or the structure would require a stronger platform?

Molte grazie
Merci
Victor
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