Pierre Fayon

Open-Source, Python-Based Redevelopment of the ChemShell Multiscale QM/MM Environment.

You Lu, Paul Sherwood, Alexey A Sokol, 2018, Journal of chemical theory and computation.

Extensions of the siesta dft code for simulation of molecules pdf

Olivier Coulaud, Ross Brown, Isabelle Baraille, 2013, ArXiv.

Formation mechanism of ultra porous framework materials.

Pierre Fayon, Abbie Trewin, P. Fayon, 2016, Physical chemistry chemical physics : PCCP.