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Location University Politehnica of Bucharest, Bucharest, Romania
Introduction PROJECT TEAM Project Coordinator - Mariana IONITA Ph.D PI - Livia Elena CRICA M.Sc student PI - Eugenia VASILE Ph. D stdent PI - Madalina PANDELE Ph.D student PI - Stefan VOICU Ph.D
Interests PROJECT SUMMARY - This project aims at an enhanced understanding and the knowledge-based design of novel polymer-graphene materials which combine a much improved trade-off between permeabilities and selectivities with various other properties needed to ensure processability and durability for high performance membranes for selective gas separation. The aim is pursued by first developing and extensive application of multiscale computer-aided molecular modeling (CAMM) and design (CAMD) complemented with computer-assisted evaluation (mainly atomistic-, quantitative structure property relationship (QSPR)- and mesoscale- tools) to be utilized to help to develop polymer (polysulfones, polyimides)-graphene membrane materials potentially attractive for air separation (O2/N2) and natural gas purification (CO2/CH4).