Multiwfn forum

yaakoub

Member

Registered: 2023-05-17

Posts: 3

ESP extreme wouldn't appear

I'm plotting ESP colored vdW surface with ESP extrema but it does not appear, when I set "ext" command i get the message "invalid command name "soource""

sobereva

Tian Lu (Multiwfn developer)

From: Beijing

Registered: 2017-09-11

Posts: 1,762

Website

Re: ESP extreme wouldn't appear

That means you didn't properly modify vmd.rc file and then reboot VMD, or the ESPext.vmd script provided in Multiwfn package has not been moved to default folder of VMD program, therefore the content of the script was not activated when VMD boots up.

yaakoub

Member

Registered: 2023-05-17

Posts: 3

Re: ESP extreme wouldn't appear

I did everything you did in the video.
What do you suggest to me?

sobereva

Tian Lu (Multiwfn developer)

From: Beijing

Registered: 2017-09-11

Posts: 1,762

Website

Re: ESP extreme wouldn't appear

I have sufficently illustrated all steps in the video tutorial, there is no hidden step(s).

yaakoub

Member

Registered: 2023-05-17

Posts: 3

Re: ESP extreme wouldn't appear

first of all I would like to thank you for your cooperation, I solve the problem, it's in the ext command line I just remove the additionnel "o" from "soource"
Best wishes.