Mackie CJ - Search Results

1

Size distribution of polycyclic aromatic hydrocarbons in space: an old new light on the 11.2/3.3 μm intensity ratio.

Lemmens AK, Mackie CJ, Candian A, Lee TMJ, Tielens AGGM, Rijs AM, Buma WJ. Lemmens AK, et al. Among authors: mackie cj. Faraday Discuss. 2023 Sep 20;245(0):380-390. doi: 10.1039/d2fd00180b. Faraday Discuss. 2023. PMID: 37294543 Free PMC article.

2

Linear transformation of anharmonic molecular force constants between normal and Cartesian coordinates.

Mackie CJ, Candian A, Huang X, Lee TJ, Tielens AG. Mackie CJ, et al. J Chem Phys. 2015 Jun 28;142(24):244107. doi: 10.1063/1.4922891. J Chem Phys. 2015. PMID: 26133410

3

The anharmonic quartic force field infrared spectra of three polycyclic aromatic hydrocarbons: Naphthalene, anthracene, and tetracene.

Mackie CJ, Candian A, Huang X, Maltseva E, Petrignani A, Oomens J, Buma WJ, Lee TJ, Tielens AG. Mackie CJ, et al. J Chem Phys. 2015 Dec 14;143(22):224314. doi: 10.1063/1.4936779. J Chem Phys. 2015. PMID: 26671382

4

The anharmonic quartic force field infrared spectra of five non-linear polycyclic aromatic hydrocarbons: Benz[a]anthracene, chrysene, phenanthrene, pyrene, and triphenylene.

Mackie CJ, Candian A, Huang X, Maltseva E, Petrignani A, Oomens J, Mattioda AL, Buma WJ, Lee TJ, Tielens AG. Mackie CJ, et al. J Chem Phys. 2016 Aug 28;145(8):084313. doi: 10.1063/1.4961438. J Chem Phys. 2016. PMID: 27586928

5

The anharmonic quartic force field infrared spectra of hydrogenated and methylated PAHs.

Mackie CJ, Candian A, Huang X, Maltseva E, Petrignani A, Oomens J, Buma WJ, Lee TJ, Tielens AGGM. Mackie CJ, et al. Phys Chem Chem Phys. 2018 Jan 3;20(2):1189-1197. doi: 10.1039/c7cp06546a. Phys Chem Chem Phys. 2018. PMID: 29242883 Free article.

6

Fully anharmonic infrared cascade spectra of polycyclic aromatic hydrocarbons.

Mackie CJ, Chen T, Candian A, Lee TJ, Tielens AGGM. Mackie CJ, et al. J Chem Phys. 2018 Oct 7;149(13):134302. doi: 10.1063/1.5038725. J Chem Phys. 2018. PMID: 30292208 Free article.

7

Structural investigation of doubly-dehydrogenated pyrene cations.

Panchagnula S , Bouwman J , Rap DB , Castellanos P , Candian A , Mackie C , Banhatti S , Brünken S , Linnartz H , Tielens AGGM . Panchagnula S , et al. Phys Chem Chem Phys. 2020 Oct 14;22(38):21651-21663. doi: 10.1039/d0cp02272a. Epub 2020 Jul 30. Phys Chem Chem Phys. 2020. PMID: 32729589

8

A Spectroscopic View on Cosmic PAH Emission.

Peeters E, Mackie C, Candian A, Tielens AGGM. Peeters E, et al. Acc Chem Res. 2021 Apr 20;54(8):1921-1933. doi: 10.1021/acs.accounts.0c00747. Epub 2021 Mar 29. Acc Chem Res. 2021. PMID: 33780617

9

Modeling the infrared cascade spectra of small PAHs: the 11.2 μm band.

Mackie CJ, Candian A, Lee TJ, Tielens AGGM. Mackie CJ, et al. Theor Chem Acc. 2021;140(9):124. doi: 10.1007/s00214-021-02807-z. Epub 2021 Aug 13. Theor Chem Acc. 2021. PMID: 34720707 Free PMC article.

10

Anharmonicity and the IR Emission Spectrum of Neutral Interstellar PAH Molecules.

Mackie CJ, Candian A, Lee TJ, Tielens AGGM. Mackie CJ, et al. J Phys Chem A. 2022 May 26;126(20):3198-3209. doi: 10.1021/acs.jpca.2c01849. Epub 2022 May 11. J Phys Chem A. 2022. PMID: 35544706

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