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17 lines
575 B
Plaintext
17 lines
575 B
Plaintext
DeFT is a density functional moleculat orbital calculation program,
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which was made by Alain St-Amant at Univ. Ottawa.
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If you are interested in DeFT, please try to contact him.
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URL:http://www.chem.uottawa.ca/st-amant/st-amant_en.html
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DeFT_2.2 may be run with MPI, but I did not try it.
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Potring to 4.0-CURRENT (__FreeBSD_version == 400005) and later versions
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have been assisted greatly by Glenn Johnson <gjohnson@nola.srrc.usda.gov>,
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thanks a lot !
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He found a couple of troublesome in optimization using g77 at FreeBSD 4,
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then it is recommended to use f2c/cc.
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--
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rmiya
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