Is it possible in CP2K to determine Individual Bond Dissociation Energy for any Bond in organic molecules?

Susmita/Rajib bkpsu... at gmail.com
Sun Jun 4 07:20:37 UTC 2017


             (*Any knowledgeable group-member is free to answer!*), 

Dear Prof. Rybkin
I am still awaiting your reply for the part: 
In the meanwhile, will it be possible for me to peruse some 
snap-/screen-shots 
of the software? Some snap-/screen-shot images of the GUI? 
Perhaps you overlooked this question at the end of my email. 
Sir, I *also* want to ask
* if cp2k is interacted with via terminal only, i.e., command-line driven, 
and doesn't have a GUI? *
Regards, 
Rajib 

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