Relaxation is one of the most fundamental phenomena in physics. A few selected examples
of relaxation processes are dielectric relaxation,[1] light-scattering relaxation [2] and the …

Nuclear spin relaxation provides detailed dynamical information on molecular systems and
materials. Here, first-principles modeling of the chemical shift anisotropy (CSA) relaxation …

Density functional theory was employed to study the dependence of 13 C and 15 N
magnetic shielding tensors on the glycosidic torsion angle (χ) and conformation of the sugar …

Synthetic 13 C= O labeling of peptides provides a means by which NMR analysis elucidates
chemical shifts that are indicative of site-specific secondary structure fold. The primary …

This thesis presents computational studies of both the static and dynamic parameters of the
nuclear magnetic resonance (NMR) spectroscopy of gaseous xenon. First, state-of-the-art …