Kjaergaard HG - Search Results

1

Cost-Effective Implementation of Multiconformer Transition State Theory for Alkoxy Radical Unimolecular Reactions.

Zhao Q, Møller KH, Chen J, Kjaergaard HG. Zhao Q, et al. Among authors: kjaergaard hg. J Phys Chem A. 2022 Sep 22;126(37):6483-6494. doi: 10.1021/acs.jpca.2c04328. Epub 2022 Sep 2. J Phys Chem A. 2022. PMID: 36053271

2

Effect of hydration on the hydrogen abstraction reaction by HO in DMS and its oxidation products.

Jørgensen S, Kjaergaard HG. Jørgensen S, et al. Among authors: kjaergaard hg. J Phys Chem A. 2010 Apr 15;114(14):4857-63. doi: 10.1021/jp910202n. J Phys Chem A. 2010. PMID: 20088555

3

Nitrate radical addition-elimination reactions of atmospherically relevant sulfur-containing molecules.

Kurtén T, Lane JR, Jørgensen S, Kjaergaard HG. Kurtén T, et al. Among authors: kjaergaard hg. Phys Chem Chem Phys. 2010 Oct 21;12(39):12833-9. doi: 10.1039/c0cp00383b. Epub 2010 Aug 27. Phys Chem Chem Phys. 2010. PMID: 20820564

4

A computational study of the oxidation of SO2 to SO3 by gas-phase organic oxidants.

Kurtén T, Lane JR, Jørgensen S, Kjaergaard HG. Kurtén T, et al. Among authors: kjaergaard hg. J Phys Chem A. 2011 Aug 11;115(31):8669-81. doi: 10.1021/jp203907d. Epub 2011 Jul 15. J Phys Chem A. 2011. PMID: 21702472

5

Fourier transform infrared spectroscopy and theoretical study of dimethylamine dimer in the gas phase.

Du L, Kjaergaard HG. Du L, et al. Among authors: kjaergaard hg. J Phys Chem A. 2011 Nov 10;115(44):12097-104. doi: 10.1021/jp206762j. Epub 2011 Oct 14. J Phys Chem A. 2011. PMID: 21950960

6

Atmospheric fate of methacrolein. 2. Formation of lactone and implications for organic aerosol production.

Kjaergaard HG, Knap HC, Ørnsø KB, Jørgensen S, Crounse JD, Paulot F, Wennberg PO. Kjaergaard HG, et al. J Phys Chem A. 2012 Jun 21;116(24):5763-8. doi: 10.1021/jp210853h. Epub 2012 May 16. J Phys Chem A. 2012. PMID: 22452294

7

On the possible catalysis by single water molecules of gas-phase hydrogen abstraction reactions by OH radicals.

Thomsen DL, Kurtén T, Jørgensen S, Wallington TJ, Baggesen SB, Aalling C, Kjaergaard HG. Thomsen DL, et al. Among authors: kjaergaard hg. Phys Chem Chem Phys. 2012 Oct 5;14(37):12992-9. doi: 10.1039/c2cp40795g. Phys Chem Chem Phys. 2012. PMID: 22903308

8

Intramolecular interactions in 2-aminoethanol and 3-aminopropanol.

Thomsen DL, Axson JL, Schrøder SD, Lane JR, Vaida V, Kjaergaard HG. Thomsen DL, et al. Among authors: kjaergaard hg. J Phys Chem A. 2013 Oct 10;117(40):10260-73. doi: 10.1021/jp405512y. Epub 2013 Sep 25. J Phys Chem A. 2013. PMID: 24001040

9

Identification and characterization of the HCl-DMS gas phase molecular complex via infrared spectroscopy and electronic structure calculations.

Bork N, Du L, Kjaergaard HG. Bork N, et al. Among authors: kjaergaard hg. J Phys Chem A. 2014 Feb 27;118(8):1384-9. doi: 10.1021/jp411567x. Epub 2014 Feb 18. J Phys Chem A. 2014. PMID: 24533924

10

Benchmarking ab initio binding energies of hydrogen-bonded molecular clusters based on FTIR spectroscopy.

Bork N, Du L, Reiman H, Kurtén T, Kjaergaard HG. Bork N, et al. Among authors: kjaergaard hg. J Phys Chem A. 2014 Jul 17;118(28):5316-22. doi: 10.1021/jp5037537. Epub 2014 Jul 2. J Phys Chem A. 2014. PMID: 24988143

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