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#2 Multiwfn and wavefunction analysis » Electron Localization Function analysis via Topmod » 2021-10-10 10:38:37

Amalda
Replies: 22

Hello, I hope you are doing well.

I am a complete beginner in electron location function (ELF) analysis. I need to learn how to do the calculation using topmod.
I only have the wfn files of the studied molecules generated by Gaussian09. I don't know how to do the other steps: grid90, bas90... Can you please help me ?

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