CCL: DFT Software



 Sent to CCL by: Holger Kruse [holger.kruse**uni-muenster.de]
 Hi,
 For Linux there a quite some gems to find on this nice summary page:
 http://www.redbrick.dcu.ie/~noel/linux4chemistry/
 some are free for academic, others are open source.
 The already mentioned gamess, or ORCA are surely worth a try for molecular
 systems
 and can also be found on the given homepage.
 regards,
 Holger Kruse
 Am Freitag, 8. April 2011, 22:46:42 schrieb Wojciech Kolodziejczyk
 dziecial*icnanotox.org:
 > Sent to CCL by: Wojciech Kolodziejczyk [dziecial_._icnanotox.org]
 > gamess. It's for free
 >
 > 2011/4/8 Raphael Martinez raphaelmartinez1983%gmail.com
 >
 > <owner-chemistry#%#ccl.net>:
 > > Sent to CCL by: "Raphael  Martinez"
 [raphaelmartinez1983/./gmail.com]
 > > What software could be inexpensive (or free better) that could run DFT
 > > calculations to small organic molecules?. A software that can give
 > > decent results and allow to include the results in a publication.
 Thanks
 > > a lot for the help.