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rezabma

Member

Registered: 2020-02-23

Posts: 29

QTAIM topological graphs for SSH connection

Hi
I need topological graphs for BCP, RCP, and CCP from Bader theory (QTAIM). I know how can I save a text file for all CP properties. My connection is SSH, and I have only terminal of a Linux. How can I save the topological graph by a ssh connection?

Thanks
Reza

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

Hi again
I used -4 option to save CP.pdb, but when I open it by gauss view, I see the following image:

Last edited by rezabma (2025-01-28 10:04:00)

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

this is for the time that I uncheck the bonds:

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

It seems that only carbon atoms should be bounded. But how? GaussView automatically shows all the bonds.

sobereva

Tian Lu (Multiwfn developer)

From: Beijing

Registered: 2017-09-11

Posts: 1,955

Website

Re: QTAIM topological graphs for SSH connection

I strongly suggest using VMD to visualize the exported CPs. And I strongly suggest using the method described in the following video tutorial to plot the map:

Using Multiwfn with VMD to quickly and easily plot high quality atoms-in-molcules (AIM) topology map
https://youtu.be/mgsnhvWH5SI

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

OK, I will test it. Thanks.

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

there are some script files (batch files if I am correct) in the YOUTUBE video. How can we get them?

Last edited by rezabma (2025-01-28 12:32:36)

rezabma

Member

Registered: 2020-02-23

Posts: 29

Re: QTAIM topological graphs for SSH connection

Thanks. I got it. I watched the Youtube Video, and did as you explained. everything is OK.