From owner-chemistry@ccl.net Sun Nov 17 01:00:01 2013 From: "Mohan maruthi sena maruthi.sena _ gmail.com" To: CCL Subject: CCL: How to use dispersion corrected B97-D with def2-SVP basis set Message-Id: <-49345-131117005841-25051-moTrz0eveErEn1wLqpdiiA^^^server.ccl.net> X-Original-From: Mohan maruthi sena Content-Type: multipart/alternative; boundary=f46d043be1a631f94904eb591fbe Date: Sun, 17 Nov 2013 11:28:34 +0530 MIME-Version: 1.0 Sent to CCL by: Mohan maruthi sena [maruthi.sena,,gmail.com] --f46d043be1a631f94904eb591fbe Content-Type: text/plain; charset=ISO-8859-1 Hello Sir, I am naive user of g09, I want to use dispersion corrected B97-D with def2-SVPFIT basis set. When I give input as following in .com file , #opt B97-D/def2-svpfit It is giving error stating unknown key word. How to give input to include above mentioned basis set in .com file. Thanks for a reply in advance, Mohan --f46d043be1a631f94904eb591fbe Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable
Hello Sir,
=A0=A0=A0=A0=A0=A0= =A0=A0=A0=A0=A0=A0=A0=A0=A0 I am naive user of g09, I want to use=A0 disper= sion corrected B97-D with def2-SVPFIT basis set. When I give input as follo= wing in .com file ,

#opt B97-D/def2-svpfit

=A0It is giving error stating unknown key wor= d.=A0 How to give input to include above mentioned basis set in .com file.<= br>
Thanks for a reply in advance,

Mohan
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