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jlopez141 / pyCSH

pyCSH: automated generation of realistic bulk calcium silicate hydrate (C-S-H) structures.
GNU General Public License v2.0
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How do I simulate CSH? #1

Closed xabimen closed 2 years ago

xabimen commented 2 years ago

How do I simulate CSH?

Thank you,

jlopez141 commented 2 years ago

It is simple. You just take the code, generate some input files (vasp, siesta or lammps), and press the play button in your selected DFT (or MD) package. And that's all! Then you can just publish a paper and put my name in it as well.

Hope this was helpful.

J.