Multiwfn forum

aitouna

Member

Registered: 2019-10-27

Posts: 20

QTAIM analysis

Hi everybody,

Can the program Multiwfn perform the QTAIM analysis developed by Prof. Richard Bader ? I hope that the answer is yes.

Sincerely,

sobereva

Tian Lu (Multiwfn developer)

From: Beijing

Registered: 2017-09-11

Posts: 1,768

Website

Re: QTAIM analysis

Multiwfn is extremely good at performing QTAIM analysis, there has been numerous published papers that employed Multiwfn for QTAIM analysis.

Please search "AIM" in the "Multiwfn quick start.pdf" document in the Multiwfn binary package, you will immediately know which sections of Multiwfn manual you should read.

Best regards,

Tian

aitouna

Member

Registered: 2019-10-27

Posts: 20

Re: QTAIM analysis

Dear Professor Tian LU,
Thank you very much, it's been a long time looking freeware and powerful software doing this analysis.

Sincerely,