Title: Toward Accurate yet Effective Computations of Rotational Spectroscopy Parameters for Biomolecule Building Blocks Authors: Vincenzo Barone, Silvia Di Grande, ...

Relaxation dynamics of 3He and 4He clusters and droplets studied using near infrared and visible fluorescence excitation spectroscopy ...

Dual-Site Model for Ab Initio Calculations of Gibbs Free Energies and Enthalpies of Adsorption: Methane in Zeolite Mobile Five ...

Selective adsorption of sulphur dioxide and hydrogen sulphide by metal–organic frameworks Authors: Sonja Grubisic,  Rahma Dahmani, Djordjevic Ivana,  ...

MD simulations explain the excess molar enthalpies in pseudo-binary mixtures of a choline chloride-based deep eutectic solvent with water ...