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#1 2022-07-12 11:37:51
- basuroyk
- Member
- Registered: 2022-07-11
- Posts: 2
citation for interfragment charge transfer (IFCT) method
Dear All,
I am quite new to Multiwfn and in general in the world of quantum chemical calculations. I have used Multiwfn to calculate charge transfer matrix between different fragments by the inter-fragment charge transfer (IFCT) method. It would be great if you could suggest a reference that I could cite to refer the IFCT method.
Best regards,
Krishnayan
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#2 2022-07-12 12:30:22
Re: citation for interfragment charge transfer (IFCT) method
Dear Krishnayan,
Currently please Multiwfn manual such as:
Tian Lu, Multiwfn manual, Section 3.21.8, available at http://sobereva.com/multiwfn
I will write introduction paper of IFCT in the future.
Best,
Tian
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#3 2022-07-12 14:03:00
- basuroyk
- Member
- Registered: 2022-07-11
- Posts: 2
Re: citation for interfragment charge transfer (IFCT) method
Dear Tian,
Thanks. So for the time being I should only cite the Multiwfn manual!
Best regards,
Krishnayan
Last edited by basuroyk (2022-07-12 14:03:20)
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