Can I use NEB to find the charge transfer intermediate ?

Houwen linu... at gmail.com
Sat Apr 4 12:13:20 UTC 2015


Dear CP2K users:
 Can I use NEB to find the charge transfer intermediate ? 
 Like this process, from D- + A  to  D + A-, if we consider this a inner 
sphere step, there must be an intermediate or transistion state . My 
confusion is how to find it out ?
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