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The mid-infrared spectra of large PAHs ranging from C54H18 to C130H28 are determined computationally using Density Functional Theory. Trends in the band positions and intensities as a function of PAH size, charge and geometry are discussed.…

Astrophysics · Physics 2012-08-27 Charles W. Bauschlicher, , Els Peeters , Louis J. Allamandola

Polarized infrared emission from polycyclic aromatic hydrocarbons (PAHs) is important for testing the basic physics of alignment of ultrasmall grains and potentially offers a new way to trace magnetic fields. In this paper, a new model of…

Astrophysics of Galaxies · Physics 2017-12-15 Thiem Hoang

Interstellar polycyclic aromatic hydrocarbon (PAHs) are an important component of the interstellar medium of galaxies, containing some 10 percent of the elemental carbon. Their vibrational emission dominates the mid-infrared spectra of…

Astrophysics of Galaxies · Physics 2026-03-06 A. G. G. M. Tielens

Polycyclic aromatic hydrocarbons (PAHs) are some of the major dust components in the interstellar medium (ISM). We present our evolution models for the abundance of PAHs in the ISM on a galaxy-evolution timescale. We consider shattering of…

Astrophysics of Galaxies · Physics 2015-06-18 Ji Yeon Seok , Hiroyuki Hirashita , Ryosuke S. Asano

This work presents theoretical calculations of infrared spectra of nitrogen (N)-containing polycyclic aromatic hydrocarbon (PAH) molecules with incorporation of N, NH and NH$_2$ using density functional theory (DFT). The properties of their…

Astrophysics of Galaxies · Physics 2021-12-30 Akant Vats , Amit Pathak , Takashi Onaka , Mridusmita Buragohain , Itsuki Sakon , Izumi Endo

We study the behaviour of polycyclic aromatic hydrocarbon emission in galaxies at z=0.3-1.4 using 1868 samples from the revised catalogue of AKARI North Ecliptic Pole Deep survey. The continuous filter coverage at 2-24um makes it possible…

Astrophysics of Galaxies · Physics 2014-07-02 K. Murata , H. Matsuhara , H. Inami , T. Wada , T. Goto , L. Armus , C. Pearson , S. Serjeant , T. Miyaji

We have obtained new STIS/HST spectra to search for structure in the ultraviolet interstellar extinction curve, with particular emphasis on a search for absorption features produced by polycyclic aromatic hydrocarbons (PAHs). The presence…

Infrared emission from polycyclic aromatic hydrocarbons (PAHs) play a major role in determining the charge balance of their host environments that include photo-dissociation regions (PDRs) in galaxies, planetary nebulae, and rims of…

The structure and chemistry of the dusty interstellar medium (ISM) are shaped by complex processes that depend on the local radiation field, gas composition, and dust grain properties. Of particular importance are Polycyclic Aromatic…

The mid-IR spectra of six large, irregular PAHs with formulae (C84H24 - C120H36) have been computed using Density Functional Theory (DFT). Trends in the dominant band positions and intensities are compared to those of large, compact PAHs as…

Astrophysics of Galaxies · Physics 2012-08-27 Charles W. Bauschlicher, , Els Peeters , Louis J. Allamandola

(Abridged) We present the results from a detailed analysis of the 0.6 - 10 keV spectra of 23 ASCA observations of 18 objects. We find that in most cases the underlying continuum can be well-represented by a powerlaw with a photon index…

Astrophysics · Physics 2008-11-26 I. M. George , T. J. Turner , Hagai Netzer , K. Nandra , R. F. Mushotzky , T. Yaqoob

We investigate the evolution of polycyclic aromatic hydrocarbon (PAH) abundance in a galaxy, which is a crucial step to understand the evolution of bright emission features in the mid-infrared range. We calculate the evolution of dust grain…

Astrophysics of Galaxies · Physics 2019-09-25 Shiau-Jie Rau , Hiroyuki Hirashita , Maria Sergeevna Murga

Relativistically broadened and redshifted 6.4 -- 6.9 keV iron K lines are observed from many accretion powered objects, including X-ray binaries and active galactic nuclei (AGN). Existence of gas close to the central engine implies large…

High Energy Astrophysical Phenomena · Physics 2021-02-24 T. Kallman , M. Bautista , J. Deprince , J. A. Garcia , C. Mendoza , A. Ogorzalek , P. Palmeri , P. Quinet

We investigate the emission properties of polycyclic aromatic hydrocarbons (PAHs) in various metallicity environments with the Infrared Spectrograph on board Spitzer. Local giant HII regions are used as references as they enable access to…

Cosmology and Nongalactic Astrophysics · Physics 2015-05-20 V. Lebouteiller , J. Bernard-Salas , D. G. Whelan , B. Brandl , F. Galliano , V. Charmandaris , S. Madden , D. Kunth

We investigate the mid-infrared (IR) emission in the Orion Bar photodissociation region, using archival photometric and spectroscopic observations from UKIRT, Spitzer, ISO, and SOFIA telescopes. Specifically, we consider flux densities of…

Astrophysics of Galaxies · Physics 2021-11-11 Maria S. Murga , Maria S. Kirsanova , Dmitry S. Wiebe , Paul A. Boley

Future and on-going infrared and radio observatories such as JWST, METIS or ALMA will increase the amount of rest-frame IR spectroscopic data for galaxies by several orders of magnitude. While studies of the chemical composition of the ISM…

Astrophysics of Galaxies · Physics 2022-10-19 Borja Pérez-Díaz , Enrique Pérez-Montero , Juan A. Fernández-Ontiveros , José M. Vílchez

In this Letter we report the results of density functional theory calculations on medium-sized neutral Polycyclic Aromatic Hydrocarbon (PAH) molecules with armchair edges. These PAH molecules possess strong C-H stretching and bending modes…

Astrophysics of Galaxies · Physics 2014-10-09 A. Candian , P. J. Sarre , A. G. G. M. Tielens

In this paper, we explore the detectability of polycyclic aromatic hydrocarbons (PAHs) under diverse planetary conditions, aiming to identify promising targets for future observations of planetary atmospheres. Our primary goal is to…

Earth and Planetary Astrophysics · Physics 2024-11-13 Rosa Arenales-Lope , Karan Molaverdikhani , Dwaipayan Dubey , Barbara Ercolano , Fabian Grübel , Christian Rab

It has been an unanswered question how many dusty galaxies have been undetected from the state-of-the-art observational surveys. JWST enables us to detect faint IR galaxies that have prominent polycyclic aromatic hydrocarbon (PAH) features…

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