Title: Quantum Computations in Heavy Noble-Gas Hydride Cations: Reference Energies and New Spectroscopic Data Authors: MJ Montes de Oca-Estévez, R ...
Title: Fine Tuning the Intermolecular Interactions of Water Clusters Using the Dispersion-Corrected Density Functional Theory Authors: A Ferretti, L Canal, ...
Title: Decoding the infrared spectra changes upon formation of molecular complexes: the case of halogen bonding in pyridine⋯ perfluorohaloarene complexes ...
Title: Structure and formation of copper cluster ions in multiply charged He nanodroplets Authors: OV Lushchikova, M Gatchell, J Reichegger, ...
Title: Family of Gaussian wavepacket dynamics methods from the perspective of a nonlinear Schr" odinger equation" Authors: J Vaníček DOI: ...
Title: Secondary ionization of pyrimidine nucleobases and their microhydrated derivatives in helium nanodroplets Authors: JD Asmussen, AR Abid, A Sundaralingam, ...
Title: Catalytic activity of 1D chains of gold oxide on a stepped gold surface from density functional theory Authors: ...
Title: An ab initio study of the photodissociation of CH2I and CH2I+ Authors: A. Bouallagui, A. Zanchet, L. Bañares and A. García-Vela DOI: https://pubs.rsc.org/en/content/articlehtml/2023/cp/d3cp01460f ...
Title: On the 12 C 2 H 2 near-infrared spectrum: absolute transition frequencies and an improved ...
Title: Imaging the photodissociation dynamics of internally excited ethyl radicals from high Rydberg states Authors: ...
