Search
Now showing items 1-10 of 12
Development of molecular models of interfaces using a multi-scale hybrid particle-field approach: application to composite materials and biomembranes
(Universita degli studi di Salerno, 2014-03-07)
The
rule
of
the
interface
in
systems
including
polymer
composites
and
block-‐
copolymer
interacting
with
biomembrane
has
been
investigated
by
computational
approach.
In
particular,
for
the
poly ...
Polymorphism and co-crystalline phases of polymers
(Universita degli studi di Salerno, 2012-02-04)
Crystalline phases are extremely relevant for properties and applications of many polymeric
materials. In fact, their amount, structure and morphology constitute the main factors controlling
physical properties of fibers, ...
New Technologies in Tires: From Layered Nanofillers to Metathesis Reactions
(Universita degli studi di Salerno, 2014-03-07)
Tires are annually manufactured in more than one billion of artefacts and the ever increasing demand is on the basis of the efforts in finding new solutions for more performant, sustainable and durable products. This PhD ...
Towards the rational design of new catalysts for organic transformations
(Universita degli studi di Salerno, 2014-02-28)
The main goal of this PhD thesis has been providing a computational support to the development of
new or better performing catalysts, leading to the synthesis of new materials.
In this context, it is worth remembering ...
A molecular dymanics view of structure and reactivity
(Universita degli studi di Salerno, 2011-02-21)
The eld of computer simulations has developed into a very important branch of science providing a guess at
the interactions between molecules to obtain predictions of properties as accurate as required, subject to ...
Transport properties of drug precursor molecules in nanoporous polymers
(Universita degli studi di Salerno, 2014-02-28)
This PhD thesis is framed in the European project CUSTOM, which aims to develop a small size
device able to detect drug precursors molecules in the air, even when they are just in traces.
The project is part of the ...
Polymeric films with co-crystalline and nanoporous crystalline phases: orientations, chirality and possible applications in photonic crystals
(Universita degli studi di Salerno, 2015)
Polymers can crystallize in different crystalline forms; polymorphism is the term to indicate this
ability. It is known that processing and physical properties of polymer-based materials are strongly
affected by the ...
Polymeric aerogels
(Universita degli studi di Salerno, 2014-03-07)
Aerogels are a unique class of materials characterized by a highly porous network, being attractive for many applications such as thermal and acoustic insulation, capacitors or catalysis.
In more recent years, polymeric ...
Functionalized Syndiotactic Polystyrene
(Universita degli studi di Salerno, 2012-02-14)
La sintesi di materiali polimerici da metodo di modificazione, per ottenere le
proprietà desiderate in polimeri, è un argomento importante in chimica dei polimeri e tecnologia. Molto spesso, proprietà desiderate non sono ...
In silico study of protein-protein interactions
(Universita degli studi di Salerno, 2013-01-30)
Protein-protein interactions are at the basis of many of the most important
molecular processes in the cell, which explains the constantly growing interest
within the scientific community for the structural characterization ...