|
Showing 1 - 3 of
3 matches in All Departments
The hydrogen bond represents an important interaction between
molecules, and the dynamics of hydrogen bonds in water create an
ever-present question associated with the process of chemical and
biological reactions. In spite of numerous studies, the process
remains poorly understood at the microscopic level because
hydrogen-bond dynamics, such as bond rearrangements and
hydrogen/proton transfer reactions, are extremely difficult to
probe. Those studies have been carried out by means of
spectroscopic methods where the signal stems from the ensemble of a
system and the hydrogen-bond dynamics were inferred indirectly.
This book addresses the direct imaging of hydrogen-bond dynamics
within water-based model systems assembled on a metal surface,
using a scanning tunneling microscope (STM). The dynamics of
individual hydrogen bonds in water clusters, hydroxyl clusters, and
water-hydroxyl complexes are investigated in conjunction with
density functional theory. In these model systems, quantum dynamics
of hydrogen bonds, such as tunneling and zero-point nuclear motion,
are observed in real space. Most notably, hydrogen atom relay
reactions, which are frequently invoked across many fields of
chemistry, are visualized and controlled by STM. This work presents
a means of studying hydrogen-bond dynamics at the single-molecule
level, providing an important contribution to wide fields beyond
surface chemistry.
The hydrogen bond represents an important interaction between
molecules, and the dynamics of hydrogen bonds in water create an
ever-present question associated with the process of chemical and
biological reactions. In spite of numerous studies, the process
remains poorly understood at the microscopic level because
hydrogen-bond dynamics, such as bond rearrangements and
hydrogen/proton transfer reactions, are extremely difficult to
probe. Those studies have been carried out by means of
spectroscopic methods where the signal stems from the ensemble of a
system and the hydrogen-bond dynamics were inferred indirectly.
This book addresses the direct imaging of hydrogen-bond dynamics
within water-based model systems assembled on a metal surface,
using a scanning tunneling microscope (STM). The dynamics of
individual hydrogen bonds in water clusters, hydroxyl clusters, and
water-hydroxyl complexes are investigated in conjunction with
density functional theory. In these model systems, quantum dynamics
of hydrogen bonds, such as tunneling and zero-point nuclear motion,
are observed in real space. Most notably, hydrogen atom relay
reactions, which are frequently invoked across many fields of
chemistry, are visualized and controlled by STM. This work presents
a means of studying hydrogen-bond dynamics at the single-molecule
level, providing an important contribution to wide fields beyond
surface chemistry.
In these lecture notes, we will analyze the behavior of random
walk on disordered mediaby means ofboth probabilistic and analytic
methods, and will study the scalinglimits. We will focus on the
discrete potential theory and how the theory is effectively used in
the analysis of disordered media.Thefirst few chapters of the notes
can be used as an introduction to discrete potential theory.
Recently, there has beensignificantprogress on thetheoryof random
walkon disordered media such as fractals and random media.Random
walk on a percolation cluster('the ant in the labyrinth')is one of
the typical examples. In 1986, H. Kesten showedtheanomalous
behavior of a random walk on a percolation cluster at critical
probability. Partly motivated by this work, analysis and diffusion
processes on fractals have been developed since the late eighties.
As a result, various new methods have been produced to estimate
heat kernels on disordered media. These developments are summarized
in the notes."
|
|