Multiwfn forum

Multiwfn official website: //www.umsyar.com/multiwfn. Multiwfn forum in Chinese: http://bbs.keinsci.com/wfn

You are not logged in.

#1 Re: Multiwfn and wavefunction analysis » Fingerprinting with Multiwfn » 2024-09-27 13:55:11

I see that a previous teacher said that the spikes in the lower left corner represent hydrogen bonds to each other left and right, so do you know what those scattered dots in the upper right corner of my drawing represent?thank you!

#2 Multiwfn and wavefunction analysis » Fingerprinting with Multiwfn » 2024-09-25 07:16:47

gao@gao@gao@gao
Replies: 3

May I ask why the fingerprints I draw with the same cif file are not the same as those of others?
image.png
And I mapped it out like this
image.png
How can you tell who's right and who's wrong?Is it something to do with the center atom chosen?

Board footer

Powered by FluxBB

Baidu
map