TeraChem: Difference between revisions
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== tests == | == tests == | ||
Some tests | [[Image:Terachem.pdf]] Some tests on version 1.0, 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 16:02, 2 February 2011
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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.
links
User's guide: http://www.petachem.com/doc/userguide.pdf
http://www.petachem.com/products.html
tests
File:Terachem.pdf Some tests on version 1.0, 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.