Jaguar

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Jaguar is a high-performance ab initio package for both gas and solution phase simulations.

Contents

Availability

Resource Centre Description
Akka HPC2N capability cluster resource of 54 TFLOPS with infiniband interconnect
Beda C3SE throughput cluster resource
Glenn C3SE throughput cluster resource

License

License: Requires license.

The software is commercial software

Experts

These experts have registered specific competence on this subject:
Field AE FTE General activities
Torben Rasmussen (NSC) NSC Computational chemistry 100100 Application expert coordinator (25% FTE).
Installation and support of computational chemistry software.
Snicdocs editing and development.

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