From owner-chemistry /at\ccl.net Mon Sep 14 02:01:01 2015 From: "mann........... navu1989mann[]gmail.com" To: CCL Subject: CCL:G: ATOMISATION ENERGY Message-Id: <-51736-150914014734-10325-onAxmDwc3IKV9idYYARXAw%x%server.ccl.net> X-Original-From: "mann..........." Content-Type: multipart/alternative; boundary=001a1147830cd28697051fae99b6 Date: Mon, 14 Sep 2015 11:17:29 +0530 MIME-Version: 1.0 Sent to CCL by: "mann..........." [navu1989mann!^!gmail.com] --001a1147830cd28697051fae99b6 Content-Type: text/plain; charset=UTF-8 Respected Sir, I have to find the atomisation energy of VO molecule by using BPW91 funtional and LANL2DZ basis set on vanadium atoms and a D95V basis set on oxygen atom by using gaussian 09. Please help me how shoud i give input for this job and procedure. I shall be highly oblized. With Regards Navjot Kaur Research scholor Panjab University Chandigarh --001a1147830cd28697051fae99b6 Content-Type: text/html; charset=UTF-8 Content-Transfer-Encoding: quoted-printable
Respected Sir,
=C2=A0 =C2=A0 =C2=A0 =C2=A0 =C2=A0 =C2= =A0 =C2=A0 =C2=A0 =C2=A0 =C2=A0 =C2=A0 =C2=A0 =C2=A0 I have to find the ato= misation energy of VO molecule by using BPW91 funtional and LANL2DZ basis s= et on vanadium atoms and a D95V basis set on oxygen atom by using gaussian = 09. Please help me how shoud i give input for this job and procedure. I sha= ll be highly oblized.

With Regards
Navjo= t Kaur
Research scholor =C2=A0
Panjab University
<= div>Chandigarh
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