TeraChem: Difference between revisions
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TeraChem is general purpose quantum chemistry software designed to run on NVIDIA GPU architectures under a 64-bit Linux operating system. | TeraChem is general purpose quantum chemistry software designed to run on NVIDIA GPU architectures under a 64-bit Linux operating system. | ||
== links == | == links == | ||
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http://www.petachem.com/products.html | http://www.petachem.com/products.html | ||
== tests == | |||
Some tests run on the version, which does not have d orbitals or ECP's. Comparison was Gaussian09 with our 8 core machines vs (ii) Terachem with a single VGA Nvidia Geforce GTX-470 card. | |||
Revision as of 16:00, 2 February 2011
go back to Main Page, Computational Resources, Computational Codes
TeraChem is general purpose quantum chemistry software designed to run on NVIDIA GPU architectures under a 64-bit Linux operating system.
links
User's guide: http://www.petachem.com/doc/userguide.pdf
http://www.petachem.com/products.html
tests
Some tests run on the version, which does not have d orbitals or ECP's. Comparison was Gaussian09 with our 8 core machines vs (ii) Terachem with a single VGA Nvidia Geforce GTX-470 card.