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Vasilios Raptis

Visiting Associate Professor, Computational Chemistry

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[email protected]

School of Sciences

Visiting Professor

Google Scholar Profile

Academic Qualifications

PhD in Chemistry	2004	National and Kapodistrian University of Athens	Department of Chemistry	Calculation of Structural, Thermodynamic, and Hydrocarbon-Transport Properties of Silicon-Containing Polymers via Molecular Simulation
MSc in Polymer Science and its Applications	2000	National and Kapodistrian University of Athens	Department of Chemistry	Force-field development for organosilicon polymers
Diploma in Chemical Engineering	1994	National Technical University of Athens	School of Chemical Engineering	Nonlinear Properties of Atoms and Molecules

Employment History

2023	2023	European University Cyprus, Distance Education Unit	Nicosia, Cyprus	Distant-learning Instructor
2023	2023	National Center for Scientific Research ‘Demokritos’, Institute of Nanoscience and Nanotechnology	Athens, Greece	Postdoctoral Research Associate
2021	2022	National Hellenic Research Foundation, Institute of Theoretical & Physical Chemistry	Athens, Greece	Postdoctoral Research Associate

Publications

2024	Graph theoretical analysis as an aid in the elucidation of structure-property relations of perovskite materials	Kaltzoglou, A.	AIP Conf. Proc.	3030	110005
2023	Synthesis and Modeling of Poly(L-lactic acid) via Polycondensation of L-Lactic Acid	Theodorou, A.; Baltzaki, C. I. M.; Manios, T.; Harmandaris, V.; Velonia, K.	Polymers	15 (23)	4569
2023	Graph Partitions in Chemistry	Michos, I.	Entropy	25 (11)	1504
2023	Interface modelling for (CH₃)₃SPbI₃ and (NH₂)₂CHPbI₃ perovskite layers	Kaltzoglou, A.	Journal of Physics and Chemistry of Solids	180	111383
2022	Molecular Dynamics Simulations of Essential Oil Ingredients Associated with Hyperbranched Polymer Drug Carriers	Karatasos, K.	Polymers	14 (9)	1762
2021	Just type polyana and press Enter: a post-processing application designed with simplicity of use in mind	Dimitroulis, C.; Raptis, T.	Mol. Simul.	47	284
2019	Theoretical aspects of a discrete-binding approach in QCM-D acoustic biosensing	Tsortos, A.; Gizeli, E.	Phys. Rev. Appl.	11	034031
2015	Molecular dynamics study of the local structure and diffusivity of partially miscible water/n-alcohols binary mixtures	Dimitroulis, C.; Kainourgiakis, E.; Samios, J.	J. Mol. Liq.	205	46
2007	A new effective method for quantitative analysis of diffusion jumps, applied in Molecular Dynamics simulations of small molecules dispersed in short chain systems	Raptis, T.; Samios, J.	J. Phys. Chem. B	111	13683
2006	Force field development for poly(dimethylsilylene-methylene), with the aid of ab initio calculations	Melissas, V.	J. Phys. Chem. B	110	14929

Exhibitions

Research Projects

1	2022	Reusable Mask Patterning - REMAP	EU funds (European Commission PathFinder programme)	Team member (Postdoctoral Research Associate)
2	2021-2022	Advanced Materials for Perovskite Solar Cells – AMPERCEL	Greek national funds (Hellenic Foundation for Research and Innovation)	Team member (Postdoctoral Research Associate)
3	2019-2020	Biowaste to Bioplastic-B2B	EU and Greek national funds through the Operational Programme Competitiveness, Enterpreneurship & Innovation	Team member (Postdoctoral Research Associate)
4	2019-2020	Aromadistill (Greek aromatic and medicinal plants exploitation)	EU and Greek national funds (Operational Programme Competitiveness, Enterpreneurship & Innovation)	Team member (Postdoctoral Research Associate)
5	2016-2019	LoveFood2Market: A portable MicroNano-BioSystem & Instrument for ultra-fast analysis of pathogens in food: Innovation from LOVE-FOOD lab prototype to a pre-commercial instrument	European Commission, Horizon2020	Team member (Postdoctoral Research Associate)
6	2015	ΚΡΗΠΙΣ: Advanced Materials for Energy Harvesting	Greek national funds (GSRT)	Team member (Postdoctoral Research Associate)
7	2008-2009	INSIDE PORES – IN SItu study and DEvelopment of processes involving nanoPORous Solids	EU funds	Team member (Postdoctoral Research Associate)
8	2006-2007	Study, development and characterization of asymmetric polymer membranes for the removal of unwanted compounds from natural gas	Greek national funds (GSRT)	Team member (Postdoctoral Research Associate)
9	2004-2006	Chemical fate of environmental pollutants: chlorinated hydrocarbons in the atmosphere and the underground water	EU and Greek national funds (GSRT)	Team member (Postdoctoral Research Associate)
10	2000-2001	Study of polymer mixtures thermodynamics and phase equilibria by means of molecular simulation, macroscopic models and experimental measurements.	Greek funds (GSRT)	Team member (Research Assistant)

*Project Role: i.e. Scientific/Project Coordinator, Research Team Member, Researcher, Assistant Researcher, other

Academic Consulting Services/Councils/Boards/Editorial Committees

Awards/International Recognition

Other Achievements