First-principles calculations of NMR parameters in solids (including the chemical shift, the
quadrupolar interaction for nuclei with spin quantum number I> 1/2, and the indirect J …

The main goal of a novel drug development is to obtain it with optimal physiochemical,
pharmaceutical and biological properties. Pharmaceutical companies and scientists modify …

Methanol synthesis by CO2 hydrogenation is a key process in a methanol‐based economy.
This reaction is catalyzed by supported copper nanoparticles and displays strong support or …

Structure investigations of biological solids by high-resolution magic-angle spinning (MAS)
solid-state NMR spectroscopy has rapidly progressed in the last few years and resulted in …

The amount and location of acid sites (strong Brønsted and weak silanols) in zeolites are
crucial for their applications. In this work we revealed the enigma of the complex H-bonded …

A new aluminum naphthalenedicarboxylate Al (OH)(1, 4-NDC)· 2H2O compound has been
synthesized. The crystal structure exhibits a three-dimensional framework composed of …

The chemical shift of a nucleus, i, in a molecule arises from the nuclear shielding effect of an
applied magnetic field, caused by an induced magnetic field resulting from circulation of …

Magic angle spinning (MAS) nuclear magnetic resonance (NMR) has evolved significantly
over the past three decades and established itself as a vital tool for the structural analysis of …

This review article describes the applications of NMR to the study of polymorphs and related
forms (solvates) of organic (especially pharmaceutical) compounds, for which it is of …

Metal halide perovskites (MHPs) are promising light harvesting and emitting materials that
have enabled solar energy conversion efficiencies of over 25% in solution-processed single …