Libra news - 9/23/2019

[Alexey Akimov]

Hi everyone,

Here are couple updates on Libra:

1) A new Tutorial on analyzing QE MD trajectories using Libra is now available here:

Source: https://github.com/Quantum-Dynamics-Hub/libra-code/blob/devel/notebooks/Example4_md/Example2_atomistic/MD.ipynb

NBViewer rendering: https://nbviewer.jupyter.org/github/Quantum-Dynamics-Hub/libra-code/blob/cd79f85776411f9726f87b36ba16ce6f1bcebdae/notebooks/Example4_md/Example2_atomistic/MD.ipynb?fbclid=IwAR2hbv-J_ID_iGAIxduoq_1p5U8st5T2CFIxc6VUxF9uNCtTs98e4Stm38A

2) We are trying to make Libra more accessible. With this in mind, the docs for the Python part of it (libra_py module) are now added in the compiled form (as a website, not just as the comments in the source code). Check it out here: 

https://quantum-dynamics-hub.github.io/libra/documentation.html

The former C++ docs are temporarily gone, but will be back later. Also, more stuff to come and to be organized in a more convenient way. So stay tuned.

Best,

Alexey