Projects
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Computational modeling of materials: from atomistic properties to new functionalities. University of Antwerp
Katholieke Universiteit Leuven, Pennsylvania State University, Izmir Institute of Technology, Federal University Ceara, Shahid Rajaee University, IMEC, Catholic University of Louvain, Université d'Orléans, Ghent University, University of Liège, University of Camerino, Electron microscopy for materials research (EMAT)
Computational modeling is an essential factor in the study of the properties of materials. Nowadays, computational modeling is extensively used to predict and develop new materials. This requires a thorough knowledge of the local atomic (structural and electronic) structure and its influence on the macroscopic properties. Although, in principle, all materials can be described with the laws of quantum mechanics, it is impossible in practice to ...
Computational modeling of materials. University of Antwerp
The goal of this Scientific Research Community (Wetenschappelijke Onderzoeksgemeenschap, WOG) of the FWO-Vlaanderen is to intensify the collaboration between the different research groups in Flanders which are active in the field of the computational modeling of materials. In addition a collaboration with the external partners will be set up or intensified.
Computational modeling of materials. University of Antwerp
In this "Scientific Research Community" we try to calculate the properties of materials by computer simulations. More specifically we study the growth of thin films and of carbon nanotubes by molecular dynamics simulations. By contact with the other research groups we hope to share and exchange our expertise.
Computational modeling of materials: from atomistic properties to new functionalities. University of Antwerp
Modelling and Simulation in Chemistry (MOSAIC), Katholieke Universiteit Leuven, Pennsylvania State University, Izmir Institute of Technology, Federal University Ceara, Shahid Rajaee University, IMEC, Catholic University of Louvain, Université d'Orléans, Ghent University, University of Liège, University of Camerino, Plasma Lab for Applications in Sustainability and Medicine - Antwerp (PLASMANT)
In this WOG, the overarching goal is to employ existing and develop new computational methodologies at the atomistic and molecular scale to model and simulate fundamental material properties to explore and understand novel material functionalities.
A Boundary Modeling Scheme to Bridge the Computational Gap Between Classic Electrodynamics and Quantum Physics KU Leuven
Classic Computational ElectroMagnetics (CEM), as the very technology modeling the interaction of EM waves with matter, has been demonstrated to be extremely successful in the progress of human kind. It can be seen as one of the enabling technologies realizing modern communication systems. Hence it is already greatly impacting peoples’ daily life. However, very recent deep-nanoscale experiments suggest the need for an entirely new way of ...
Digital characterization of coarse recycled aggregate and computational modeling for recycled concrete KU Leuven
This research aims to promote the application of computer-aided technique on construction materials by developing a 3D mesoscale computational model of recycled concrete in order to comprehend the effects of material properties on the recycled concrete system. Therefore, the following project tasks are determined based on the digital technique and computational analysis: (1) 3D morphology quantification and modeling of recycled aggregate; (2) ...
Computational modeling of materials: from atomistic properties to new functionalities. University of Antwerp
Katholieke Universiteit Leuven, Pennsylvania State University, Izmir Institute of Technology, Federal University Ceara, Shahid Rajaee University, IMEC, Catholic University of Louvain, Université d'Orléans, Ghent University, University of Liège, University of Camerino, Condensed Matter Theory
The WOG "Computational modeling of materials" aims to: - Promote interdisciplinary computational material research, bringing together groups from physics, chemistry and materials science, and providing them with a platform on which to share their expertise in order to arrive at an integrated and pragmatic approach in order to develop opto-electronic, thermodynamic and structural properties of materials to study. - Develop new techniques and ...