Curran HJ - Search Results

1

Revisiting the Kinetics and Thermodynamics of the Low-Temperature Oxidation Pathways of Alkanes: A Case Study of the Three Pentane Isomers.

Bugler J, Somers KP, Silke EJ, Curran HJ. Bugler J, et al. Among authors: curran hj. J Phys Chem A. 2015 Jul 16;119(28):7510-27. doi: 10.1021/acs.jpca.5b00837. Epub 2015 Apr 1. J Phys Chem A. 2015. PMID: 25798548

2

Experimental and modeling study of methyl cyclohexane pyrolysis and oxidation.

Orme JP, Curran HJ, Simmie JM. Orme JP, et al. Among authors: curran hj. J Phys Chem A. 2006 Jan 12;110(1):114-31. doi: 10.1021/jp0543678. J Phys Chem A. 2006. PMID: 16392847

3

Thermochemistry of acetonyl and related radicals.

El-Nahas AM, Bozzelli JW, Simmie JM, Navarro MV, Black G, Curran HJ. El-Nahas AM, et al. Among authors: curran hj. J Phys Chem A. 2006 Dec 21;110(50):13618-23. doi: 10.1021/jp065003y. J Phys Chem A. 2006. PMID: 17165890

4

Experimental and modeling study of C5H10O2 ethyl and methyl esters.

Metcalfe WK, Dooley S, Curran HJ, Simmie JM, El-Nahas AM, Navarro MV. Metcalfe WK, et al. Among authors: curran hj. J Phys Chem A. 2007 May 17;111(19):4001-14. doi: 10.1021/jp067582c. Epub 2007 Feb 7. J Phys Chem A. 2007. PMID: 17284020

5

Enthalpies of formation, bond dissociation energies and reaction paths for the decomposition of model biofuels: ethyl propanoate and methyl butanoate.

El-Nahas AM, Navarro MV, Simmie JM, Bozzelli JW, Curran HJ, Dooley S, Metcalfe W. El-Nahas AM, et al. Among authors: curran hj. J Phys Chem A. 2007 May 17;111(19):3727-39. doi: 10.1021/jp067413s. Epub 2007 Feb 8. J Phys Chem A. 2007. PMID: 17286391

6

Enthalpies of formation and bond dissociation energies of lower alkyl hydroperoxides and related hydroperoxy and alkoxy radicals.

Simmie JM, Black G, Curran HJ, Hinde JP. Simmie JM, et al. Among authors: curran hj. J Phys Chem A. 2008 Jun 5;112(22):5010-6. doi: 10.1021/jp711360z. Epub 2008 May 8. J Phys Chem A. 2008. PMID: 18461912 Free article.

7

Formation enthalpies and bond dissociation energies of alkylfurans. The strongest CX bonds known?

Simmie JM, Curran HJ. Simmie JM, et al. Among authors: curran hj. J Phys Chem A. 2009 Apr 30;113(17):5128-37. doi: 10.1021/jp810315n. J Phys Chem A. 2009. PMID: 19331407

8

Energy barriers for the addition of H, *CH3, and *C2H5 to *CH2=CHX [X = H, CH3, OH] and for H-atom addition to RCH=O [R = H, CH3, *C2H5, n-C3H7]: implications for the gas-phase chemistry of enols.

Simmie JM, Curran HJ. Simmie JM, et al. Among authors: curran hj. J Phys Chem A. 2009 Jul 9;113(27):7834-45. doi: 10.1021/jp903244r. J Phys Chem A. 2009. PMID: 19518123

9

Ab initio chemical kinetics of methyl formate decomposition: the simplest model biodiesel.

Metcalfe WK, Simmie JM, Curran HJ. Metcalfe WK, et al. Among authors: curran hj. J Phys Chem A. 2010 May 6;114(17):5478-84. doi: 10.1021/jp9120436. J Phys Chem A. 2010. PMID: 20380414

10

A multiple shock tube and chemical kinetic modeling study of diethyl ether pyrolysis and oxidation.

Yasunaga K, Gillespie F, Simmie JM, Curran HJ, Kuraguchi Y, Hoshikawa H, Yamane M, Hidaka Y. Yasunaga K, et al. Among authors: curran hj. J Phys Chem A. 2010 Sep 2;114(34):9098-109. doi: 10.1021/jp104070a. J Phys Chem A. 2010. PMID: 20690588

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