BANNEDBYGAUSSIAN.ORG

Banned By Gaussian

Who is Gaussian, Inc? The recipient of the 1998 Nobel Prize in Chemistry, has not been associated with Gaussian, Inc. since 1991. The departure (and subsequent banning) of Professor Pople from the Gaussian project marked a sad day for science, a day in which commerce trumped science and loyalty. The goal of this site is to shed light on some practices of Gaussian, Inc. that can undermine basic scientific ideals. What is meant by Banned By Gaussian? Simply: YOU CAN NOT USE THE GAUSSIAN PROGRAM! Further, u...

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Who is Gaussian, Inc? The recipient of the 1998 Nobel Prize in Chemistry, has not been associated with Gaussian, Inc. since 1991. The departure (and subsequent banning) of Professor Pople from the Gaussian project marked a sad day for science, a day in which commerce trumped science and loyalty. The goal of this site is to shed light on some practices of Gaussian, Inc. that can undermine basic scientific ideals. What is meant by Banned By Gaussian? Simply: YOU CAN NOT USE THE GAUSSIAN PROGRAM! Further, u...

<META> KEYWORDS

1 Gaussian

2 Hartree

3 Fock

4 DFT

5 Density Functional

6 Coupled Cluster

7 Moller-Plesset

8 Perturbation

9 MP2

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Banned By Gaussian | bannedbygaussian.org Reviews

https://bannedbygaussian.org

Who is Gaussian, Inc? The recipient of the 1998 Nobel Prize in Chemistry, has not been associated with Gaussian, Inc. since 1991. The departure (and subsequent banning) of Professor Pople from the Gaussian project marked a sad day for science, a day in which commerce trumped science and loyalty. The goal of this site is to shed light on some practices of Gaussian, Inc. that can undermine basic scientific ideals. What is meant by Banned By Gaussian? Simply: YOU CAN NOT USE THE GAUSSIAN PROGRAM! Further, u...

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bannedbygaussian.org

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Banned By Gaussian

http://www.bannedbygaussian.org/reviewing.htm

Brief Guidelines for Theoretical Calculations can be found in the ACS journals where editorial policies are discussed, e.g., the first issue of the year of J. Phys. Chem. A, etc. The detailed guidelines are outlined in the following articles:. 1 Pure Appl. Chem. 1998, vol. 70, p. 1015. 2 Pure Appl. Chem. 1998, vol. 70, p. 2047. And among the conclusions are:.

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blog.christophjacob.eu

Christoph | The Frozen Density

https://blog.christophjacob.eu/author/christophjacob

All posts by Christoph. How Open are Commercial Scientific Software Packages? July 18, 2015. A revised version of this post has been published as a Viewpoint in the Journal of Physical Chemistry Letters, DOI: 10.1021/acs.jpclett.5b02609. In quantum chemistry, many program packages are available [1]. Study, change, and distribute the software to anyone and for any purpose. Others are owned by commercial companies who sell them to both academic groups and industry users for a small or large fee. Interm...

blog.christophjacob.eu

open science | The Frozen Density

https://blog.christophjacob.eu/tag/open-science

Tag Archives: open science. How Open are Commercial Scientific Software Packages? July 18, 2015. A revised version of this post has been published as a Viewpoint in the Journal of Physical Chemistry Letters, DOI: 10.1021/acs.jpclett.5b02609. In quantum chemistry, many program packages are available [1]. Study, change, and distribute the software to anyone and for any purpose. Others are owned by commercial companies who sell them to both academic groups and industry users for a small or large fee. In...

blog.christophjacob.eu

theoretical chemistry | The Frozen Density

https://blog.christophjacob.eu/tag/theoretical-chemistry

Tag Archives: theoretical chemistry. How Open are Commercial Scientific Software Packages? July 18, 2015. A revised version of this post has been published as a Viewpoint in the Journal of Physical Chemistry Letters, DOI: 10.1021/acs.jpclett.5b02609. In quantum chemistry, many program packages are available [1]. Study, change, and distribute the software to anyone and for any purpose. Others are owned by commercial companies who sell them to both academic groups and industry users for a small or large fe...

freechemical.info

Why you

http://www.freechemical.info/why/whyyou.php

August 25, 2016. Why you should help us. You might be the next. Please, suggest your chemistry software here:.

blog.christophjacob.eu

How Open are Commercial Scientific Software Packages? | The Frozen Density

https://blog.christophjacob.eu/2015/07/18/how-open-are-commercial-scientific-software-packages/comment-page-1

How Open are Commercial Scientific Software Packages? July 18, 2015. A revised version of this post has been published as a Viewpoint in the Journal of Physical Chemistry Letters, DOI: 10.1021/acs.jpclett.5b02609. In quantum chemistry, many program packages are available [1]. Study, change, and distribute the software to anyone and for any purpose. Others are owned by commercial companies who sell them to both academic groups and industry users for a small or large fee. Intermediate models (free, but...

dirtdobber.blogspot.com

Dobbing Around: November 2010

http://dirtdobber.blogspot.com/2010_11_01_archive.html

Thoughts on Software Development, Leadership, Presentations, Science and . Whatever Interests Me At Present. Technical Debt - NSF wants to know. Every time a new piece of software is added to the code base, Baker said, an addition is made to its technical debt. Code is the principal, and software maintenance is the interest payment. So the more code we have out there, the bigger our debt, hence the more maintenance, hence the more interest payments.". Push To Measure Technical Debt. Links to this post.

msg.ameslab.gov

Gordon Group/GAMESS Homepage

http://www.msg.ameslab.gov/index.html

Mark Gordon's Quantum Theory Group. Ames Laboratory/Iowa State University. Is now available for Mac OS X, Linux and Windows. Version 7 now includes a model building/editing feature! A simple batch job manager for desktop platforms named GamessQ. Is available for OS X, Windows, or Linux desktops. Other Sites of Interest. Open Collaborations Push Science Forward. USC iOpenShell Electronic Structure Forum. Quantum Chemistry Group, Sapporo, Japan: Segmented Gaussian Basis Sets. UCLA Virtual Chemistry Library.

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Wednesday, February 13, 2013. The Dog And The Deputy. Http:/ www.gazettetimes.com/blogs/any-given-lundy/the-dog-and-the-deputy/article b51b1a04-64db-5f23-ac0d-f2c65516090d.html. Look Ma, I am finally somebody! Saturday, March 24, 2012. Appriciate the kind words as of late VH, Tom. I think I am just getting burnt out on the GT forum(s). I am taking things way to personal, and clearly my sense of humor just doesn't translate on the threads. Subscribe to: Posts (Atom). The Dog And The Deputy.

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bannedbygaussian.org

Banned By Gaussian

Who is Gaussian, Inc? The recipient of the 1998 Nobel Prize in Chemistry, has not been associated with Gaussian, Inc. since 1991. The departure (and subsequent banning) of Professor Pople from the Gaussian project marked a sad day for science, a day in which commerce trumped science and loyalty. The goal of this site is to shed light on some practices of Gaussian, Inc. that can undermine basic scientific ideals. What is meant by Banned By Gaussian? Simply: YOU CAN NOT USE THE GAUSSIAN PROGRAM! Further, u...

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