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Clusters of polycyclic aromatic hydrocarbon (PAH) molecules are modelled using explicit all-atom potentials using a rigid body approximation. The PAH's considered range from pyrene (C10H8) to circumcoronene (C54H18), and clusters containing…

Chemical Physics · Physics 2016-09-28 M. Rapacioli , F. Calvo , F. Spiegelman , C. Joblin , D. J. Wales

Intensity ratios of aromatic emission features are widely used to diagnose the size and ionization state of polycyclic aromatic hydrocarbons (PAHs) in astronomical environments. However, PAHs are known to typically carry aliphatic side…

Astrophysics of Galaxies · Physics 2026-05-12 Zhuang Zhang , Yong Zhang

We present maps of the dust properties in the Small and Large Magellanic Clouds (SMC, LMC) from fitting Spitzer and Herschel observations with the \citet{DL07} dust model. We derive the abundance of the small carbonaceous grain (or…

In order to find out capable molecular source of astronomically well observed infrared (IR) spectrum, asymmetric molecular configuration polycyclic aromatic hydrocarbon (PAH) was analyzed by the density functional theory (DFT) analysis.…

Astrophysics of Galaxies · Physics 2015-10-27 Norio Ota

We present a sample of resolved galactic HII regions and photodissociation regions (PDRs) observed with the Spitzer infrared spectrograph (IRS) in spectral mapping mode between the wavelengths of 5--15 $\mu$m. For each object we have…

Infrared observations from the Spitzer Space Telescope archive are used to study the dust component of the interstellar medium in the IC~10 irregular galaxy. Dust distribution in the galaxy is compared to the distributions of H$\alpha$ and…

Astrophysics of Galaxies · Physics 2011-07-15 D. S. Wiebe , O. V. Egorov , T. A. Lozinskaya

The so-called unidentified infrared emission (UIE) features at 3.3, 6.2, 7.7, 8.6, and 11.3 $\mu$m ubiquitously seen in a wide variety of astrophysical regions are generally attributed to polycyclic aromatic hydrocarbon (PAH) molecules.…

Astrophysics of Galaxies · Physics 2017-03-22 Xuejuan Yang , Aigen Li , R. Glaser , J. X. Zhong

Polycyclic Aromatic Hydrocarbons (PAHs) are believed to be the small-size tail of the interstellar carbonaceous dust grain population. Their vibrational emission is the most widely accepted source of the aromatic near-infrared features, and…

Astrophysics of Galaxies · Physics 2015-08-21 Yacine Ali-Haïmoud , Laura Pérez , Ronald Maddalena , Anish Roshi

Aims. The chemistry of, and infrared (IR) emission from, polycyclic aromatic hydrocarbons (PAHs) in disks around Herbig Ae/Be and T Tauri stars are investigated. The equilibrium distribution of the PAHs over all accessible…

The signatures of polycyclic aromatic hydrocarbons (PAHs) have been observed in protoplanetary discs, and their emission features obtained from spectral energy distributions (SED) have been used in the literature to characterise their size…

Earth and Planetary Astrophysics · Physics 2023-11-22 K. Lange , C. Dominik , A. G. G. M. Tielens

Polycyclic aromatic hydrocarbon (PAH) molecules have long been suggested to be present in the interstellar medium (ISM). Nevertheless, despite their expected ubiquity and sustained searching efforts, identifying specific interstellar PAH…

Astrophysics of Galaxies · Physics 2024-03-12 Kaijun Li , Aigen Li , Xuejuan Yang , Taotao Fang

Evolved stars are primary sources for the formation of polycyclic aromatic hydrocarbons (PAHs) and dust grains. Their circumstellar chemistry is usually designated as either oxygen-rich or carbon-rich, although dual-dust chemistry objects,…

Solar and Stellar Astrophysics · Physics 2015-12-23 N. L. J. Cox , P. Pilleri , O. Berne , J. Cernicharo , C. Joblin

Spitzer and AKARI observations have found that polycyclic aromatic hydrocarbons (PAHs) are present in nearby elliptical galaxies, but their spatial distributions are still unknown. In order to investigate their distributions, we performed…

Cosmology and Nongalactic Astrophysics · Physics 2015-05-19 Hidehiro Kaneda , Takashi Onaka , Itsuki Sakon , Tetsu Kitayama , Yoko Okada , Toyoaki Suzuki , Daisuke Ishihara , Mitsuyoshi Yamagishi

We examine the dependence of polycyclic aromatic hydrocarbon (PAH) band intensity ratios as a function of the average number of carbon atoms and assess their effectiveness as tracers for PAH size, utilising the data, models, and tools…

Astrophysics of Galaxies · Physics 2023-07-19 A. Maragkoudakis , E. Peeters , A. Ricca , C. Boersma

We present adaptive optics high angular resolution ($\sim0.1\arcsec$) spectroscopic observations in the 3 \um region of eight well known Herbig Ae/Be stars with circumstellar disks. We detect the aromatic emission feature at 3.3 \um for…

Astrophysics · Physics 2009-11-10 Emilie Habart , Antonella Natta , Leonardo Testi , Marcel Carbillet

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

We extend the prediction of vibrational spectra to large sized polycyclic aromatic hydrocarbon (PAH) molecules comprising up to \sim 1500 carbon atoms by evaluating the efficiency of several computational chemistry methodologies. We employ…

Polycyclic Aromatic Hydrocarbons (PAHs) have been detected throughout the universe where they play essential roles in the evolution of their environments. For example, they are believed to affect atmospheric loss rates of close-in planets…

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

We investigate the polycyclic aromatic hydrocarbon (PAH) emission features of T Cha, a G8-type T Tauri star that has exhibited "seesaw"-type mid-infrared continuum variability over nearly two decades due to the destruction of the disk's…

Solar and Stellar Astrophysics · Physics 2025-07-30 R. Arun
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