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Tuning crystal structures with weak interactions: From solid solutions to stoichiometric cocrystals
This thesis shows that when two organic compounds A and B are cocrystallized and the
A∙∙∙B interactions are neither completely isotropic nor anisotropic enough to cause the formation
of a stoichiometric cocrystal AxBy, ...
From collective relaxation phenomena to phase separation in binary mixtures and some contributions to the hydration dynamics in the vicinity of biologically active molecules
The thesis presents detailed results of theoretical analyses based on extensive computer
simulation studies with an aim to explore, quantify whenever possible, and
understand the collective excitations, relaxation processes ...
Organic Transformations in the Confined Cavity of Self-Assembled Pd(II) Molecular Containers
Biological systems utilize its extraordinary ability to develop complex and functional molecular
assemblies employing reversible non-covalent interactions. These natural aesthetic examples
motivated synthetic chemists ...
Investigation of strongly correlated paramagnetic state at sub-Kelvin regime for S ≥ 1/2 systems: Role of disorder and dimensionality
A magnetic system usually orders ferro- or anti-ferromagnetically at temperatures
comparable to interaction strength between the spins. Moreover, an interacting
spin system tends to order with the increase of dimensionality ...