Ionic fragmentation products of benzonitrile as important intermediates in the growth of polycyclic aromatic hydrocarbons
In various astronomical environments such as the interstellar medium or (exo) planetary
atmospheres, an interplay of bottom-up growth and top-down destruction processes of …
atmospheres, an interplay of bottom-up growth and top-down destruction processes of …
Evolution of fullerenes in circumstellar envelopes by carbon condensation: insights from reactive molecular dynamics simulations
Z Meng, Z Wang - Monthly Notices of the Royal Astronomical …, 2023 - academic.oup.com
Fullerenes, including C60 and C70, have been detected in various astronomical
environments. Understanding how their structures evolve over time is essential for gaining …
environments. Understanding how their structures evolve over time is essential for gaining …
Molecular Hydrogen Formation via Vibrational Excitation of Partially Superhydrogenated Pyrenes
While polycyclic aromatic hydrocarbons (PAHs) are now accepted to be abundant in
interstellar space, the abundance and influence of superhydrogenated PAHs (HPAHs) in the …
interstellar space, the abundance and influence of superhydrogenated PAHs (HPAHs) in the …
Augmentation of Universal Potentials for Broad Applications
Universal potentials open the door for DFT level calculations at a fraction of their cost. We
find that for application to systems outside the scope of its training data, CHGNet\cite …
find that for application to systems outside the scope of its training data, CHGNet\cite …
Bending the rules of PAH hydrogenation: the case of corannulene
M Leccese, R Jaganathan, L Slumstrup… - Monthly Notices of …, 2023 - academic.oup.com
The interaction of a curved polycyclic aromatic hydrocarbon (PAH), corannulene (C20H10),
with H-atoms leading to the formation of highly superhydrogenated species was studied. In …
with H-atoms leading to the formation of highly superhydrogenated species was studied. In …
Gas Phase IR Spectra of Hydrogen Functionalised Pentacene
We present gas-phase infrared (IR) spectra of protonated dihydropentacene, the hydrogen
functionalised form of the linear, catacondensed, polycyclic aromatic hydrocarbon (PAH) …
functionalised form of the linear, catacondensed, polycyclic aromatic hydrocarbon (PAH) …
[PDF][PDF] Hidden in the dark
K Lange - core.ac.uk
The distant unknown is the driver of our curiosity. It is the inherent spark that ignites our
search for knowledge and understanding. It can be joyfully rewarding, but unfortunately also …
search for knowledge and understanding. It can be joyfully rewarding, but unfortunately also …