From owner-chemistry@ccl.net Wed Jan 1 14:08:01 2014 From: "Partha Sengupta anapspsmo:gmail.com" To: CCL Subject: CCL: MOMO-LUMO energy gap. Message-Id: <-49495-140101065651-9137-7g0sJY/SmDgupaJ2xVOi2Q:-:server.ccl.net> X-Original-From: Partha Sengupta Content-Type: multipart/alternative; boundary=047d7bd6c70ad9f00d04eee75e24 Date: Wed, 1 Jan 2014 17:26:43 +0530 MIME-Version: 1.0 Sent to CCL by: Partha Sengupta [anapspsmo~~gmail.com] --047d7bd6c70ad9f00d04eee75e24 Content-Type: text/plain; charset=ISO-8859-1 I am calculating the model reaction of a primary amine with aldehyde and found that the LUMO energy increases in the transition state and HOMO-LUMO gap became high. Initially the amine and aldehyde are forming reaction intermediate at a distance of 1.8 A. For the second step, when the transition state is found it (HOMO-LUMO energy gap) also behaves. Help is needed. Partha Sengupta -- Dr. Partha Sarathi Sengupta Associate Professor Vivekananda Mahavidyalaya, Burdwan --047d7bd6c70ad9f00d04eee75e24 Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable
I am calculating the model reaction of a primary amine wit= h aldehyde
and found that the LUMO=A0 energy increas= es in the transition state and HOMO-LUMO gap became high. Initially the ami= ne and aldehyde are forming reaction=A0 intermediate at a distance of 1.8 A= . For the second step, when the transition state is found it=A0 (HOMO-LUMO = energy gap) also behaves. Help is needed.
Partha Sengupta
--
Dr. Partha Sarathi Sengupt= a
Associate Professor
Vivekananda Mahavidyalaya, Burdwan
--047d7bd6c70ad9f00d04eee75e24-- From owner-chemistry@ccl.net Wed Jan 1 14:42:00 2014 From: "Joseph Leonard jleonard42%%gmail.com" To: CCL Subject: CCL: Recommend a scanner with OCR for literature Message-Id: <-49496-140101122655-6040-KP3byABLGjB1m/u+mrKnhw-,-server.ccl.net> X-Original-From: Joseph Leonard Content-Type: multipart/alternative; boundary=089e010d84e64131e904eeebfb3d Date: Wed, 1 Jan 2014 12:26:46 -0500 MIME-Version: 1.0 Sent to CCL by: Joseph Leonard [jleonard42=-=gmail.com] --089e010d84e64131e904eeebfb3d Content-Type: text/plain; charset=ISO-8859-1 Folks, can anybody recommend a scanner that can take a multi-page document and scan it into a PDF using OCR to render text rather than graphics? This can be an all-in-1 or a standalone scanner. I would prefer something in the $300 or less range but I'm flexible. Suggestions greatly appreciated! Best wishes for 2014! Joe Leonard -- Oh, the pointing again! They're screwdrivers! What are you going to do? Assemble a cabinet at them? --089e010d84e64131e904eeebfb3d Content-Type: text/html; charset=ISO-8859-1 Content-Transfer-Encoding: quoted-printable Folks, can anybody recommend a scanner that can take a multi-page document = and scan it into a PDF using OCR to render text rather than graphics? =A0Th= is can be an all-in-1 or a standalone scanner. I would prefer something in = the $300 or less range but I'm flexible. Suggestions greatly appreciate= d!

Best wishes for 2014!

Joe Leonard



--
Oh, the pointing again! They're screw= drivers! What are you going to do? Assemble a cabinet at them?
--089e010d84e64131e904eeebfb3d-- From owner-chemistry@ccl.net Wed Jan 1 23:15:01 2014 From: "singh singh++yamanashi.ac.jp" To: CCL Subject: CCL: MOMO-LUMO energy gap. 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