[CP2K-user] ALMO-EDA extension for fragments cleaving single bonds

Joe Greenstone green... at pobox.com
Sun Mar 8 02:48:30 UTC 2020


Hi,

Is this extension to ALMO-EDA for fragments cleaving single bonds 
implemented in CP2K, and if not are there plans to implement it?
https://www.pnas.org/content/114/48/12649


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