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#1 2021-03-20 10:54:53

HemanthH
Member
Registered: 2021-03-20
Posts: 1

Multiwfn Fails on Ubuntu 20.04

Hello Professor Lu,

I tried to run Multiwfn on Ubuntu 20.04, and found that it crashes soon after reading the .fchk file. I tried .fchk files of various sizes, but none of them seemed to work. Any advice on this would be much appreciated.

Regards,
Hemanth

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#2 2021-03-20 12:45:34

sobereva
Tian Lu (Multiwfn developer)
From: Beijing
Registered: 2017-09-11
Posts: 1,631
Website

Re: Multiwfn Fails on Ubuntu 20.04

Dear Hemanth,

Have you configured your system according to Section 2.1.2 of Multiwfn manual? The "ulimit -s unlimited" is particularly important.

Best regards,

Tian

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