Rotational Excitation Cross Sections for Chloronium Based on a New 5D Interaction Potential with Molecular Hydrogen
Title: Rotational Excitation Cross Sections for Chloronium Based on a New 5D Interaction Potential with Molecular Hydrogen Authors: Sándor Demes, ...
Adsorption of molecular hydrogen on extended graphene prototypes decorated with sodium: a quantum-mechanical study
Title: Adsorption of molecular hydrogen on extended graphene prototypes decorated with sodium: a quantum-mechanical study Authors: E. García-Arroyo, Massimiliano Bartolomei, ...
MARVEL Analysis of High-Resolution Rovibrational Spectra of 16O13C18O
Title: MARVEL Analysis of High-Resolution Rovibrational Spectra of 16O13C18O Authors: A. A. A. Azzam, J. Tennyson, S. N. Yurchenko, T. ...
Deep Eutectic Solvents Meet Non-Aqueous Cosolvents: A Modeling and Simulation Perspective─A Tutorial Review
Deep eutectic solvents (DESs) have recently gained attention due to their tailorable properties and versatile applications in several fields, including green chemistry, pharmaceuticals, and energy sto...
Borophene nanoclusters: Energetics and structures from analytical potentials
Boron shows a variety of properties, determining a chemistry rich and complementary to that of carbon, the neighbor atom in the Periodic Table. In this work, we investigated the strength and nature of...
