16 citations · 16 across the 2 of their papers we have counts for
2 papers
astro-ph.GA2021
Anharmonic Infrared Spectra of Thermally Excited Pyrene(CH): the combined view of DFT-based GVPT2 with AnharmonicCaOs and approximate DFT molecular dynamics with DemonNano
Shubhadip Chakraborty, Giacomo Mulas, Mathias Rapacioli +1
The study of the Aromatic Infrared Bands (AIBs) in astronomical environments has opened interesting spectroscopic questions on the effect of anharmonicity on the infrared (IR) spec…
physics.chem-ph2019★ 16 cited
Experimental Approach to the Study of Anharmonicity in the Infrared Spectrum of Pyrene from 14 to 723 K
Shubhadip Chakraborty, Giacomo Mulas, Karine Demyk +1
Quantifying the effect of anharmonicity on the infrared spectrum of large molecules such as polycyclic aromatic hydrocarbons (PAHs) at high temperature is the focus of a number of…