Documentation

Below you will find a number of guides to various codes and facilities that CCP-NC supports.

Using CASTEP for NMR calculations.
The .magres file format.
Young User Guide.
CASTEP pseudopotential library browser help.
Materials Studio (bulk systems)
Materials Studio (isolated systems)
How to perform nucleus independent chemical shift calculations using CASTEP and pynics

Code documentation:

MagresView
MagresPython
Soprano
pynics

Find CCP-NC on github

Please get in touch if you would like addition support on any of these topics or have suggestions for documentation improvements.