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Popular pages
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CASTEP/Getting CASTEP
Academic use The CASTEP Developers' Group (CDG) and Cambridge Enterprise are excited to announce a cost-free worldwide source code license to CASTEP and NMR CASTEP for academic use. The CDG looks forw...
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CASTEP/About CASTEP
CASTEP is a full-featured materials modelling code based on a first-principles quantum mechanical description of electrons and nuclei. It uses the robust methods of a plane-wave basis set and pseudopo...
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Tutorials/Running CASTEP
The following tutorials all require you to run CASTEP. We assume that you have the latest version of CASTEP set up on your machine of choice and that you can run it from the command line. If you have...
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CASTEP/Documentation
On-line Documentation and Downloadable User Guide The complete online CASTEP Documentation and the downloadable CASTEP User Guide (200+ page PDF) from Materials Studio - created by Dassault Systèmes B...
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CASTEP/Online Tutorials
A brief guide to compiling CASTEP How to run CASTEP Tutorial 1 : Basics and Bonding Tutorial 2 : Band Structure and Density of States Tutorial 3 : Convergence Testing Tutorial 4 : Elastic Constan...
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Tutorials/Basics And Bonding
Introduction The aim of this exercise is to familiarise you with CASTEP input and output files and running the code, some associated utilities and conversion programs. You will run some simple and sma...