mirror of
https://git.FreeBSD.org/ports.git
synced 2024-12-15 03:14:23 +00:00
16 lines
438 B
Plaintext
16 lines
438 B
Plaintext
DeFT is a density functional moleculat orbital
|
|
calculation program.
|
|
|
|
Basis sets are prepared for H to Xe.
|
|
|
|
WWW: http://www.chem.uottawa.ca/DeFT.html
|
|
|
|
Potring to 4.0-CURRENT (__FreeBSD_version == 400005) and later versions
|
|
have been assisted greatly by Glenn Johnson <gjohnson@nola.srrc.usda.gov>,
|
|
thanks a lot !
|
|
He found a couple of troublesome in optimization using g77 at FreeBSD 4,
|
|
then it is recommended to use f2c/cc.
|
|
|
|
--
|
|
rmiya
|