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Gmane
From: John Kitchin <jkitchin <at> andrew.cmu.edu>
Subject: org in the wild update
Newsgroups: gmane.emacs.orgmode
Date: Thursday 6th February 2014 21:45:04 UTC (over 2 years ago)
Hi everyone,

Our fourth scientific paper that was prepared with org-mode has been
accepted!  Each of these files has freely available supporting information
files created from org-mode with the org-source embedded in them. At the
end of these files are the directions for how we exported the pdf file out
of them. It has been pretty fun writing these papers, and we are at a point
now where all new papers are written this way in my group. Below are some
of the (org-relevant) features in each paper. Anyway, I want to thank
everyone who contributes to org-mode development. It has fundamentally
changed how we write our papers. Best wishes,

1. This paper has an embedded json file that contains all the data in the
paper and the details of the calculations we did.

Mehta, Prateek; Salvador, Paul; Kitchin, John, *Identifying Potential BO2
Oxide Polymorphs for Epitaxial Growth Candidates*", ACS Applied Materials
and Interfaces, accepted 1/27/2014.
http://pubs.acs.org/doi/full/10.1021/am4059149.



2. In this SI, there are tables in the embedded org-file that were used for
analysis, but not printed in the SI file because they were too long.


Spencer D. Miller, Vladimir V. Pushkarev, Andrew J. Gellman and John R.
Kitchin, *Simulating Temperature Programmed Desorption of Oxygen on Pt(111)
Using DFT Derived Coverage Dependent Desorption Barriers*, Topics In
Catalysis, 57(1), 106-117 (2013).
http://link.springer.com/article/10.1007%2Fs11244-013-0166-3


3. this paper contains the code developed for running these calculations.


Zhongnan Xu and John R Kitchin, *Relating the Electronic Structure and
Reactivity of the 3d Transition Metal Monoxide Surfaces*, Catalysis
Communications, Accepted Oct 2013.
http://dx.doi.org/10.1016/j.catcom.2013.10.028



4. This paper has embedded Excel sheets in the SI, which contain data used
in the paper.


Alex Hallenbeck and John R. Kitchin, *Effects of O2 and SO2 on the Capture
Capacity of a Primary-Amine Based Polymeric CO2 Sorbent*, I&ECR, 52 (31),
10788-10794 (2013). http://dx.doi.org/10.1021/ie400582a.



John

-----------------------------------
John Kitchin
Associate Professor
Doherty Hall A207F
Department of Chemical Engineering
Carnegie Mellon University
Pittsburgh, PA 15213
412-268-7803
http://kitchingroup.cheme.cmu.edu
 
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