The Materials Modeling and Design Group (MMDG) in the Department of Chemistry at the University of Crete was established in 2001. We perform research in designing, modeling and investigating properties of nanostructures and porous materials for Energy, Enviromental and Health applications.
MMDG is supervised by Professor George E. Froudakis.
The MMDG group has broad experience in modeling nanomaterials. Multi-scale computational techniques are developed in house and used for simulating large systems with accurate quantum chemistry methods. Most simulations are based on Density Functional Theory (DFT), Monte Carlo and Molecular Dynamics methodology. In addition, the group has considerable experience in high–accuracy ab–initio techniques (MP2–4, CC, CAS–SCF, MRDCI) for the study of structural, bonding, electronic and spectroscopic properties of molecules and clusters. Recently, a new computational methodology for large-scale screening of materials with the use of Machine Learning algorithms (ML) was developed.
Group site: https://www.chemistry.uoc.gr/mmdg/
GitHub: https://github.com/frudakis-research-group
X: https://x.com/mmdg_uoc?s=21 @mmdg_uoc
Instagram: https://www.instagram.com/mmdg_uoc/profilecard/?igsh=MTJzdHBjY3UxbDluMw== @mmdg_uoc
Company Details
- Employees
- 5
- Founded
- -
- Address
- University Of Crete Voutes Campus, Heraklion,crete,greece,71300,greece
- Industry
- Research Services
- NAICS
-
Scientific Research and Development ServicesResearch and Development in the Physical, Engineering, and Life SciencesResearch and Development in the Physical, Engineering, and Life Sciences (except Nanotechnology and Biotechnology)
- Keywords
- Materials Modeling, MOFs, Porous Materials, Quantum Chemistry, DFT, Mode Carlo Simulations, Molecular Dynamics Simulations, Machine Learning, Ab-initio, Computational Chemistry, Materials Informatics, Hydrogen Storage, Light gasses, Drug delivery.
- HQ
- Heraklion, Crete, Greece
Materials Modeling And Design Group Questions
Materials Modeling And Design Group's website is https://www.chemistry.uoc.gr/mmdg/
Materials Modeling And Design Group's LinkedIn profile is https://gr.linkedin.com/company/mmdg-uoc
Materials Modeling And Design Group has
5 employees.
View email and phone details for 5
employees at Materials Modeling And Design Group.
Materials Modeling And Design Group's industry is
Research Services
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Materials Modeling And Design Group's categories are Research Services
Materials Modeling And Design Group's founding year is 2001
