28 citations · 128 across the 12 of their papers we have counts for
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Vectorial Imaging of the Photodissociation of 2-Bromobutane Oriented via Hexapolar State Selection
Masaaki Nakamura, Po-Yu Tsai, Shiun-Jr Yang +6
Molecular orientation techniques are becoming available in the study of elementary chemical processes, in order to highlight those structural and dynamical properties that would be…
Nucleophilic substitution vs elimination reaction of bisulfide ions with substituted methanes: exploration of chiral selectivity by stereodirectional first-principles dynamics and transition state theory
Marcos Vinicius C. S. Rezende, Nayara D. Coutinho, Federico Palazzetti +2
Control of molecular orientation is emerging as crucial for the characterization of the stereodynamics of kinetics processes beyond structural stereochemistry. The special role pla…
Spherical and hyperspherical harmonics representation of van der Waals aggregates
Andrea Lombardi, Federico Palazzetti, Vincenzo Aquilanti +4
The representation of the potential energy surfaces of atom molecule or molecular dimers interactions should account faithfully for the symmetry properties of the systems, preservi…
The spherical-harmonics representation for the interaction between diatomic molecules: the general case and applications to CO-CO and CO-HF
Patricia R. P. Barreto, Ana Claudia P. S. Cruz, Rodrigo L. P. Barreto +5
The spherical-harmonics expansion is a mathematically rigorous procedure and a powerful tool for the representation of potential energy surfaces of interacting molecular systems, d…
Interactions of Hydrogen Molecules with Halogen-Containing Diatomics from Ab Initio Calculations: Spherical-Harmonics Representation and Characterization of the Intermolecular Potentials
Alessandra F. Albernaz, Vincenzo Aquilanti, Patricia R. P. Barreto +5
For the prototypical diatomic-molecule - diatomic molecule interactions H2-HX and H2-X2, where X = F, Cl, Br, quantum-chemical ab initio calculations are carried out on grids of th…
Hexapole-Oriented Asymmetric-Top Molecules and Their Stereodirectional Photodissociation Dynamics
Masaaki Nakamura, Shiun-Jr. Yang, Po-Yu Tsai +6
Molecular orientation is a fundamental requisite in the study of stereodirected dynamics of collisional and photoinitiated processes. In this last decade, variable hexapolar electr…
Stereodirectional Photodynamics: Experimental and Theoretical Perspectives
Federico Palazzetti, Andrea Lombardi, Shiun-Jr. Yang +5
Hexapole oriented 2-bromobutane is photodissociated and detected by a slice ion imaging technique at 234 nm. The laser wavelength corresponds to the C Br bond breaking with emissio…
Rotational state-selection and alignment of chiral molecules by electrostatic hexapoles
Federico Palazzetti, Andrea Lombardi, Masaaki Nakamura +5
Electrostatic hexapoles are revealed as a powerful tool in the rotational state-selection and alignment of molecules to be utilized in beam experiments on collisional and photoinit…