Two JCTC papers on CP2K

[Vladimir Rybkin]

The author - Dr. Sandra Luber - has become a Swiss National Science 
Foundation assistant professor at the University of Zurich!
Congratulations here!


четверг, 2 марта 2017 г., 16:11:10 UTC+1 пользователь William Tao написал:
>
> 1. Raman Optical Activity Spectra from Density Functional Perturbation 
> Theory and Density-Functional-Theory-Based Molecular Dynamics
> http://pubs.acs.org/doi/abs/10.1021/acs.jctc.6b00820
>
> 2. Dehydrogenation Free Energy of Co2+(aq) from Density Functional 
> Theory-Based Molecular Dynamics
> http://pubs.acs.org/doi/abs/10.1021/acs.jctc.6b01077
>
> PS: not my papers :-)
>
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