Carter EA - Search Results

1

Ab Initio Kinetics of Hydrogen Abstraction from Methyl Acetate by Hydrogen, Methyl, Oxygen, Hydroxyl, and Hydroperoxy Radicals.

Tan T, Yang X, Krauter CM, Ju Y, Carter EA. Tan T, et al. Among authors: carter ea. J Phys Chem A. 2015 Jun 18;119(24):6377-90. doi: 10.1021/acs.jpca.5b03506. Epub 2015 May 28. J Phys Chem A. 2015. PMID: 25974050

2

Bonding and adhesion at the SiC/Fe interface.

Johnson DF, Carter EA. Johnson DF, et al. Among authors: carter ea. J Phys Chem A. 2009 Apr 23;113(16):4367-73. doi: 10.1021/jp8110259. J Phys Chem A. 2009. PMID: 19284747

3

Accurate bond energies of hydrocarbons from complete basis set extrapolated multi-reference singles and doubles configuration interaction.

Oyeyemi VB, Pavone M, Carter EA. Oyeyemi VB, et al. Among authors: carter ea. Chemphyschem. 2011 Dec 9;12(17):3354-64. doi: 10.1002/cphc.201100447. Epub 2011 Nov 3. Chemphyschem. 2011. PMID: 22052831

4

Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicals.

Tan T, Pavone M, Krisiloff DB, Carter EA. Tan T, et al. Among authors: carter ea. J Phys Chem A. 2012 Aug 23;116(33):8431-43. doi: 10.1021/jp304811z. Epub 2012 Aug 10. J Phys Chem A. 2012. PMID: 22830521

5

First-principles predictions of the structure, stability, and photocatalytic potential of Cu2O surfaces.

Bendavid LI, Carter EA. Bendavid LI, et al. Among authors: carter ea. J Phys Chem B. 2013 Dec 12;117(49):15750-60. doi: 10.1021/jp406454c. Epub 2013 Oct 18. J Phys Chem B. 2013. PMID: 24138294

6

Accurate bond energies of biodiesel methyl esters from multireference averaged coupled-pair functional calculations.

Oyeyemi VB, Keith JA, Carter EA. Oyeyemi VB, et al. Among authors: carter ea. J Phys Chem A. 2014 Sep 4;118(35):7392-403. doi: 10.1021/jp412727w. Epub 2014 Mar 31. J Phys Chem A. 2014. PMID: 24621192

7

Revisiting photoemission and inverse photoemission spectra of nickel oxide from first principles: implications for solar energy conversion.

Alidoust N, Toroker MC, Carter EA. Alidoust N, et al. Among authors: carter ea. J Phys Chem B. 2014 Jul 17;118(28):7963-71. doi: 10.1021/jp500878s. Epub 2014 Apr 17. J Phys Chem B. 2014. PMID: 24689856 Free PMC article.

8

Trends in bond dissociation energies of alcohols and aldehydes computed with multireference averaged coupled-pair functional theory.

Oyeyemi VB, Keith JA, Carter EA. Oyeyemi VB, et al. Among authors: carter ea. J Phys Chem A. 2014 May 1;118(17):3039-50. doi: 10.1021/jp501636r. Epub 2014 Apr 18. J Phys Chem A. 2014. PMID: 24708179

9

Correction to "Ab initio reaction kinetics of hydrogen abstraction from methyl formate by hydrogen, methyl, oxygen, hydroxyl, and hydroperoxy radicals".

Tan T, Pavone M, Krisiloff DB, Carter EA. Tan T, et al. Among authors: carter ea. J Phys Chem A. 2015 Mar 12;119(10):2186. doi: 10.1021/acs.jpca.5b01185. Epub 2015 Feb 19. J Phys Chem A. 2015. PMID: 25695734 No abstract available.

10

Bond dissociation energies of C10 and C18 methyl esters from local multireference averaged-coupled pair functional theory.

Oyeyemi VB, Dieterich JM, Krisiloff DB, Tan T, Carter EA. Oyeyemi VB, et al. Among authors: carter ea. J Phys Chem A. 2015 Apr 9;119(14):3429-39. doi: 10.1021/jp512974k. Epub 2015 Mar 25. J Phys Chem A. 2015. PMID: 25775253

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