The book provides a comprehensive collection of knowledge about the theory and practice of polymer multiscale modelling methods with significant breadth.
The book provides a comprehensive collection of knowledge about the theory and practice of polymer multiscale modelling methods with significant breadth.
Doros Theodorou received his Diploma in Chemical Engineering from the National Technical University of Athens in 1982, and his M.S. (1983) and Ph.D. (1985) degrees from the Department of Chemical Engineering at the Massachusetts Institute of Technology. He is currently Professor of Chemical Engineering at the National Technical University of Athens. He has previously been Professor of Chemical Engineering at the University of California, Berkeley (1986-1995), and at the University of Patras (1995-2002). From 1986 to 1995 he also held an appointment at the Centre for Advanced Materials in the Division of Materials Sciences at Lawrence Berkeley Laboratory. Vlasis Mavrantzas received his Diploma in Chemical Engineering from the National Technical University of Athens in 1988 and his Ph.D. from the University of Delaware, Department of Chemical Engineering, in 1994. Currently he is Professor of Chemical Engineering at the University of Patras. Since 2016, he is also employed as Dozent-Lecturer in the Department of Mechanical and Process Engineering at ETH Zürich. From 1997 to 2003 he worked at FORTH-ICE/HT in Patras. He has previously been visiting researcher of the Dow Chemical Company and of the University of Tokyo.
Inhaltsangabe
1: Models for Polymer Chains 2: From Electronic Structure Calculations to Classical Force Fields 3: Molecular Mechanics 4: Molecular Dynamics 5: Monte Carlo 6: Techniques for the Analysis and Simulation of Infrequent Events. 7: Coarse-graining 8: Entanglement Network-based Simulations of Deformation and Flow 9: Dissipitative Particle Dynamics 10: Beyond-equilibrium Simulations Based on Principles of Non-equilibrium Thermodynamics
1: Models for Polymer Chains 2: From Electronic Structure Calculations to Classical Force Fields 3: Molecular Mechanics 4: Molecular Dynamics 5: Monte Carlo 6: Techniques for the Analysis and Simulation of Infrequent Events. 7: Coarse-graining 8: Entanglement Network-based Simulations of Deformation and Flow 9: Dissipitative Particle Dynamics 10: Beyond-equilibrium Simulations Based on Principles of Non-equilibrium Thermodynamics
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