[CP2K-user] [CP2K:16804] Density Corrected DFT

timdu...@gmail.com timduignan at gmail.com
Tue Apr 5 04:23:06 UTC 2022


Hello, 

I am wondering if any knows or has implemented density corrected DFT in 
CP2K? 

As described here: 
https://chemrxiv.org/engage/chemrxiv/article-details/62468f9358f7af2f0eae6081

ie compute SCAN energies with HF density?

Thanks very much 
Tim Duignan

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