CAN THE CRYSTALLIZATION OF CONJUGATED POLYMERS BE TAKEN INTO ACCOUNT IN SIMPLE MESOSCOPIC MODELS ?

Autor:	P.O. Baburkin, M.D. Malyshev, V.A. Ivanov, P.V. Komarov
Jazyk:	ruština
Rok vydání:	2019
Předmět:	hydrogel conjugated polymers crystallization mesoscopic modeling Physical and theoretical chemistry QD450-801
Zdroj:	Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов, Iss 11, Pp 398-405 (2019)
Druh dokumentu:	article
ISSN:	2226-4442 2658-4360
DOI:	10.26456/pcascnn/2019.11.398
Popis:	The problem is considered of constructing coarse-grained models of matrices of conjugated polymers with regard to their crystallization. The performed simulation within the framework of the method of dissipative particle dynamics shows that to simulate the crystallization process, flexible-semi-flexible chains with thermodynamically incompatible blocks can be used.
Databáze:	Directory of Open Access Journals
Externí odkaz:	https://doaj.org/article/a771cd51bc5d4316a7617e1375913729 Zobrazit plný text záznamu View record in DOAJ