[QE-users] Problem with Cholesky

[Kazume NISHIDATE]

Dear Aritri

As far as I know, it suppress the parallel operation in the diagonalization.

敬具　西館
best regards

nisidate at iwate-u.ac.jp
kazume.nishidate at gmail.com
2022年2月8日 20:19 +0900、Aritri Roy <aritrits at kgpian.iitkgp.ac.in> のメール:
> HI,
> While running some NEB calculations I faced a problem with computing Cholesky. But adding "-ndiag 1" to the command line solved that problem. But how does this command solve this problem? I would appreciate any insight you can provide.
> Regards,
> Aritri Roy
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