Multiwfn forum

Rudzani#2003

Member

Registered: 2025-08-11

Posts: 1

Failer to generate the BCP path

When I am following the procedure of topology Analysis, Multiwfn shows that it can not locate (3,+3) CP. How can I resolve this issue so that it can locate them, and what can I be doing wrong which is leading to this error?

sobereva

Tian Lu (Multiwfn developer)

From: Beijing

Registered: 2017-09-11

Posts: 2,045

Website

Re: Failer to generate the BCP path

If your purpose is generating path from BCP, you should select option "8 Generating the paths connecting (3,-3) and (3,-1) CPs" rather than "9 Generating the paths connecting (3,+1) and (3,+3) CPs", the former doesn't need (3,+3).