Search Results - "Desmet, Gilles"
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Computational Investigation of the Aminolysis of RAFT Macromolecules
Published in Journal of organic chemistry (02-12-2016)“…This work presents a detailed computational study and kinetic analysis of the aminolysis of dithioates, dithiobenzoates, trithiocarbonates, xanthates, and…”
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Quantitative First-Principles Kinetic Modeling of the Aza-Michael Addition to Acrylates in Polar Aprotic Solvents
Published in Journal of organic chemistry (16-12-2016)“…This work presents a detailed computational study and kinetic analysis of the aza-Michael addition of primary and secondary amines to acrylates in an aprotic…”
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Computational Study and Kinetic Analysis of the Aminolysis of Thiolactones
Published in Journal of organic chemistry (04-09-2015)“…The aminolysis of three differently α-substituted γ-thiolactones (C4H5OSX, X = H, NH2, and NH(CO)CH3) is modeled based on CBS-QB3 calculated free energies…”
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Ab‐Initio‐Based Kinetic Modeling to Understand RAFT Exchange: The Case of 2‐Cyano‐2‐Propyl Dodecyl Trithiocarbonate and Styrene
Published in Macromolecular rapid communications. (01-01-2018)“…Ab‐initio‐calculated rate coefficients for addition and fragmentation in reversible‐addition fragmentation chain transfer (RAFT) polymerization of styrene with…”
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Cellulose functionalization via high-energy irradiation-initiated grafting of glycidyl methacrylate and cyclodextrin immobilization
Published in Radiation physics and chemistry (Oxford, England : 1993) (01-12-2011)“…Cotton-cellulose was functionalized using gamma-irradiation-induced grafting of glycidyl methacrylate (GMA) to obtain a hydrophobic cellulose derivative with…”
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