Monte Carlo Algorithm Based on Internal Bridging Moves for the Atomistic Simulation of Thiophene Oligomers and Polymers - Tsourtou, Flora D; Peroukidis, Stavros D; Peristeras, Loukas D; Mavrantzas, Vlasis G (Macromolecules, 2018)
Keywords: algorithms; molecular dynamics; phase transition; polyethylene; potential energy; prediction; temperature; thiophene