CASTEP

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CASTEP is an electronic structure calculation code within density functional theory. In general, it is used for obtaining material properties. In particular, it is used for theoretical spectroscopy, including the core region.

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Availability

No installations reported.


License

License: Requires license.

CASTEP is not free. A valid license is required for running it. There is a source code license for European Academics covering a research group, see link. It is also available together with Materials Studio from Accelrys.


Experts

No experts have currently registered expertise on this specific subject. List of registered field experts:
Field AE FTE General activities
Erik Fransson (C3SE) C3SE Computational materials science 100100 Various modification and analysis tool development
Johan Raber (NSC) NSC Computational chemistry 5050
Michael Stenrup (UPPMAX) UPPMAX Computational chemistry 2525
Pavlin Mitev (UPPMAX) UPPMAX Computational materials science 4545
Torben Rasmussen (NSC) NSC Computational chemistry 100100 Application expert coordinator (25% FTE).
Installation and support of computational chemistry software.
Snicdocs editing and development.
Weine Olovsson (NSC) NSC Computational materials science 9090 Application support, installation and help

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