Introducing memory in coarse-grained molecular simulations
Preserving the correct dynamics at the coarse-grained (CG) level is a pressing problem in
the development of systematic CG models in soft matter simulation. Starting from the seminal …
the development of systematic CG models in soft matter simulation. Starting from the seminal …
Chaotic behaviour of disordered nonlinear lattices
B Senyange - arXiv preprint arXiv:2104.11696, 2021 - arxiv.org
This thesis focuses on the mechanisms of energy transport in multidimensional
heterogeneous lattice models, studying in particular the case of the Klein-Gordon model of …
heterogeneous lattice models, studying in particular the case of the Klein-Gordon model of …
[HTML][HTML] Development of Bottom-up and Iterative Methods for Non-Markovian Coarse-Grained Modeling of Molecular Dynamics
V Klippenstein - tuprints.ulb.tu-darmstadt.de
While computational power has been steadily increasing throughout the recent decades,
computational modeling in terms of atomistic molecular dynamics simulations is still limited …
computational modeling in terms of atomistic molecular dynamics simulations is still limited …
[HTML][HTML] In-silico study on perovskites application in capturing and distorting coronavirus
The COVID-19 pandemic, known as coronavirus pandemic, a global pandemic, emerged
from the beginning of 2020 and became dominant in many countries. As COVID-19 is one of …
from the beginning of 2020 and became dominant in many countries. As COVID-19 is one of …