8 citations · 12 across the 4 of their papers we have counts for
6 papers
Formation of adducts of CH with Na, Mg and Al metal cations by radiative association
Niyazi Bulut, Octavio Roncero, Maria Mallo +6
The Mg-bearing cations MgCH, MgCH, MgCN, and MgCN have been recently observed in the carbon-rich envelope IRC\,+10216. These species are thought to…
Thioacetaldehyde (CH3CHS) on interstellar ices: a key molecule to unravel two chemical dichotomies in the ISM
María Mallo, Miguel Sanz-Novo, Marcelino Agúndez +6
Thioacetaldehyde (CH3CHS), recently detected in TMC-1, has an abundance approximately 36 times lower than its oxygen analog, acetaldehyde (CH3CHO). This makes the CH3CHS/CH3CHO pai…
Laboratory spectroscopy, theoretical characterization, and astronomical search for syn-propenethial (CH2CHCHS)
Germán Molpeceres, Carlos Cabezas, Marcelino Agúndez +5
We report the laboratory characterization of the higher-energy isomer of propenethial, syn-CH2CHCHS. While the lower-energy isomer, anti-CH2CHCHS, was detected in the interstellar…
Ion-molecule routes towards cycles in TMC-1. An automated study of the C2H4 + CH2CCH+ reaction
María Mallo, Marcelino Agúndez, Carlos Cabezas +3
Cyclopentadiene (c-C5H6) is considered a key molecule in the formation of polycyclic aromatic hydrocarbons (PAHs) in the interstellar medium (ISM). The synthesis of PAHs from simpl…
Piecing together formic acid isomerism in dark clouds. Detection of cis-formic acid in TMC-1 and astrochemical modeling
G. Molpeceres, M. Agúndez, M. Mallo +6
The presence of molecular isomers in interstellar environments has become a topic of growing interest within the astrochemical community. Contrary to predictions based on thermodyn…
Delayed photoisomerisation of the trans-PSB3 retinal toy model using on-the-fly quantum dynamics
María Mallo, Susana Gómez-Carrasco, Sandra Gómez
We explore the trans-cis photoisomerisation process in a representative retinal protonated Schiff base known as trans-PSB3, employing the quantum dynamics method direct dynamics va…