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CCL
November 19, 2007
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An archive of computation chemistry related software
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Collections of data sets of use to computational chemists
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Collections of faq's and other documentation for various different programs
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From:
"Sabry Ahmed" <sabry.ea|-|gmail.com>
Date:
Mon, 19 Nov 2007 08:46:10 +0300
Subject:
CCL:G: Freq=HinderedRotor in G03W
From:
"nagarajan paramasivam" <nagarajan^^ncbs.res.in>
Date:
Mon, 19 Nov 2007 01:34:10 -0500
Subject:
CCL: WinGamess : ddilick.exe TCP error in recv
From:
"nagarajan paramasivam" <nagarajan^ncbs.res.in>
Date:
Mon, 19 Nov 2007 01:37:49 -0500
Subject:
CCL: WinGamess : ddilick.exe TCP error in recv
From:
"Markus Thut" <markus.thut||iac.unibe.ch>
Date:
Mon, 19 Nov 2007 11:52:14 +0100
Subject:
CCL:G: AW: CIS Optimization for the First Singlet Excited State
From:
"Tom de Greef" <t.f.a.d.greef() tue.nl>
Date:
Mon, 19 Nov 2007 03:35:15 -0500
Subject:
CCL:G: PCM thermodynamics
From:
"Anthony De Crisci" <antonio.decrisci^-^utoronto.ca>
Date:
Mon, 19 Nov 2007 08:41:59 -0500
Subject:
CCL:G: NLO hyperpolarizability calculation --> gamma tensors (THG)?
From:
drmsaravanan[*]aim.com
Date:
Fri, 16 Nov 2007 05:39:47 -0500
Subject:
CCL: Looking for a structure to name conversion software
From:
"Oliver T. Hofmann" <o.hofmann() tugraz.at>
Date:
Mon, 19 Nov 2007 16:58:24 +0100
Subject:
CCL:G: G03: Counterpoise correction / Unable to project occupied orbitals !
From:
"Imran Predhanekar" <imranpkm###gmail.com>
Date:
Mon, 19 Nov 2007 12:19:08 -0500
Subject:
CCL: NBO view
From:
Greg Warren <greg_+_eyesopen.com>
Date:
Mon, 19 Nov 2007 10:35:23 -0700
Subject:
CCL: Looking for a structure to name conversion software
From:
Isaac Bersuker <bersuker[-]mail.cm.utexas.edu>
Date:
Mon, 19 Nov 2007 12:46:04 -0600
Subject:
CCL:G: NLO hyperpolarizability calculation --> gamma tensors (THG)?
From:
ysubboti===ucalgary.ca
Date:
Mon, 19 Nov 2007 14:37:36 -0700 (MST)
Subject:
CCL:G: NBO view
From:
Sue Lam <chsue2004.:.yahoo.com>
Date:
Mon, 19 Nov 2007 19:04:09 -0800 (PST)
Subject:
CCL:G: AW: CIS Optimization for the First Singlet Excited State