CCL:G: Iodine basis set



 Sent to CCL by: Marcel Swart [marcel.swart(_)icrea.es]
 Go to http://bse.pnl.gov/bse
 where you can select iodine and see which basis sets are
 available for it, and then choose one of them.
 Quoting "aps1968##googlemail.com" <owner-chemistry^^^ccl.net>:
 
 Sent to CCL by: aps1968/./googlemail.com
 Dear colleagues,
 I want to perform a geometry optimization in Gaussian 03 (HF, B3LYP)
 of certain molecules containing
 Iodine, using basis set TZVP. It appears that Iodine is not included.
 What can I do?
 Cheers,
 Andrzej
 
 ===================================
 dr. Marcel Swart
 ICREA researcher at
 Institut de Química Computacional
 Universitat de Girona
 Parc Científic i Tecnològic
 Edifici Jaume Casademont (despatx A-27)
 Pic de Peguera 15
 17003 Girona
 Catalunya (Spain)
 tel
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 http://iqc.udg.edu/~marcel
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