2009-03 | A generalized differential constitutive equation for polymer melts based on principles of nonequilibrium thermodynamics | Stephanou, Pavlos S.; Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 1017 |
2010-01 | Advanced Monte Carlo Algorithm for the Atomistic Simulation of Short- and Long-Chain Branched Polymers: Implementation for Model H-Shaped, A(3)AA(3) Multiarm (Pom-Pom), and Short-Chain Branched Polyethylene Melts | Baig, Chunggi; Alexiadis, Orestis; Mavrantzas, Vlasis G. | ARTICLE | 913 |
2010-08 | Flow Effects on Melt Structure and Entanglement Network of Linear Polymers: Results from a Nonequilibrium Molecular Dynamics Simulation Study of a Polyethylene Melt in Steady Shear | Baig, Chunggi; Mavrantzas, Vlasis G.; Kroger, Martin | ARTICLE | 888 |
2010 | From atomistic trajectories to primitive paths to tube models: linking atomistic simulations with the reptation theory of polymer dynamics | Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 993 |
2010-12 | Melt Structure and Dynamics of Unentangled Polyethylene Rings Rouse Theory, Atomistic Molecular Dynamics Simulation, and Comparison with the Linear Analogues | Tsolou, Georgia; Stratikis, Nikos; Baig, Chunggi; Stephanou, Pavlos S.; Mavrantzas, Vlasis G. | ARTICLE | 894 |
2009-04 | Multiscale simulation of polymer melt viscoelasticity: Expanded-ensemble Monte Carlo coupled with atomistic nonequilibrium molecular dynamics | Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 715 |
2011-02 | On Maxwell's Relations of Thermodynamics for Polymeric Liquids away from Equilibrium | Baig, Chunggi; Mavrantzas, Vlasis G.; Oettinger, Hans Christian | ARTICLE | 844 |
2011-01 | Projection of atomistic simulation data for the dynamics of entangled polymers onto the tube theory: calculation of the segment survival probability function and comparison with modern tube models | Stephanou, Pavlos S.; Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 993 |
2010-03 | Quantifying chain reptation in entangled polymer melts: Topological and dynamical mapping of atomistic simulation results onto the tube model | Stephanou, Pavlos S.; Baig, Chunggi; Tsolou, Georgia; Mavrantzas, Vlasis G.; Kroeger, Martin | ARTICLE | 981 |
2021-09 | Special Issue on "Monte Carlo Simulation of Soft Matter Systems" EDITORIAL | Mavrantzas, Vlasis G.; Peristeras, Loukas D.; Baig, Chunggi | ARTICLE | 126 |
2010-01 | Tension thickening, molecular shape, and flow birefringence of an H-shaped polymer melt in steady shear and planar extension | Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 754 |
2011-09 | Toward an Improved Description of Constraint Release and Contour Length Fluctuations in Tube Models for Entangled Polymer Melts Guided by Atomistic Simulations | Stephanou, Pavlos S.; Baig, Chunggi; Mavrantzas, Vlasis G. | ARTICLE | 906 |
2010-10 | Understanding Dynamics in Binary Mixtures of Entangled cis-1,4-Polybutadiene Melts at the Level of Primitive Path Segments by Mapping Atomistic Simulation Data onto the Tube Model | Baig, Chunggi; Stephanou, Pavlos S.; Tsolou, Georgia; Mavrantzas, Vlasis G.; Kroeger, Martin | ARTICLE | 846 |