Аннотация:
As a supplement to the widely used general AMBER force field, a set of parameters is proposed for molecular dynamics modeling of the structure and properties of polymer chains in polyalkylsiloxane matrices of materials capable of selfhealing after stress loads.
Ключевые слова:
siloxanes, GAFF, force field, polydimethylsiloxane, molecular mechanics.
Поступила в редакцию: 30.07.2024 Принята в печать: 03.10.2024