CCL: using the aug-cc-pv6z basis set



 Sent to CCL by: Tanja van Mourik [t.vanmourik=-=ucl.ac.uk]
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 address--.
 Dear Sujata,
 > I'm trying to perform a ccsd(t)/aug-cc-pV6Z calculation (on a molecule =
 > containing aluminum) with the  G03 software. The job runs for about 2 =
 > seconds and crashes giving the message:=20
 > Standard basis: Aug-CC-pV6Z (5D, 7F)=20
 > Atomic number out of range in CCPV6Z.=20
 > =20
 It sounds like the Al aug-cc-pV6Z basis set is not (yet) implemented
 as a standard basis set in Gaussian. Just download it from the EMSL
 basis set order form:
 http://www.emsl.pnl.gov/forms/basisform.html
 and input it as a general basis set.
 Hope that helps,
 Tanja
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    Tanja van Mourik
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    Chemistry Department
    University College London  phone:  +44 (0)20-7679-4663
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