54 citations · 179 across the 15 of their papers we have counts for
15 papers
Computed Rotational Collision Rate Coefficients for Recently Detected Anionic Cyanopolyynes
L. González-Sánchez, A. Veselinova, A. Martín Santa Daría +7
We report new results from quantum calculations of energy-transfer processes taking place in interstellar environments and involving two newly observed molecular species: CN$^-…
Classical and Quantum Orbital Correlations in the Molecular Electronic States
Onur Pusuluk, Mahir H. Yesiller, Gokhan Torun +3
The quantum superposition principle has been extensively utilized in the quantum mechanical description of the bonding phenomenon. It explains the emergence of delocalized molecula…
Vibrational Quenching of CN- in Collisions with He and Ar
Barry Mant, Ersin Yurtsever, Lola González-Sánchez +2
The vibrational quenching cross sections and corresponding low-temperature rate constants for the v = 1 and v = 2 states of CN- colliding with He and Ar atoms have been computed ab…
Energy-transfer Quantum Dynamics of HeH with He atoms: Rotationally Inelastic Cross Sections and Rate Coefficients
Franco Gianturco, Kousik Giri, Lola Gonzalez-Sanchez +3
Two different ab initio potential energy surfaces are employed to investigate the efficiency of the rotational excitation channels for the polar molecular ion HeH interacting w…
The structure of 1,3-butadiene clusters
J. Douady, A. Simon, M. Rapacioli +3
Molecular clusters of 1,3-butadiene were theoretically investigated using a variety of approaches, encompassing classical force fields and different quantum chemical (QC) methods,…
Rovibrational quenching of C-anions in collisions with He, Ne, and Ar atoms
Barry P. Mant, Franco A. Gianturco, Roland Wester +2
The dicarbon molecular anion is currently of interest as a candidate for laser cooling due to its electronic structure and favorable branching ratios to the ground electronic and v…