. 2024 Oct 21;128(43):10537–10540. doi: 10.1021/acs.jpcb.4c06018

Table 1. Details of the References, Polymer Systems, Force Fields, and Computed T_g.

Reference	System	Force Field	Simulated T_g [K]	Mol. wt.[kg/mol]
Wu¹⁰	PEO	OPLS	270 (bulk)	2.2
			260 (film)
Habasaki¹⁴	PEO	OPLS	250	1, 2
Klajmon et al.¹¹	PEG	OPLS	269 ± 21	1–10
Gudla et al.¹²	PEO-LiTFSI	GAFF	285–320	1.1
Webb et al.¹⁵	PEO-LiTFSI	TraPPE-UA	275	2.5
Fang et al.¹⁶	PEO-LiTFSI	OPLS-AA	250–260	2.6
Gullbrekken et al.¹⁷	PEO-LiTFSI	OPLS-AA	250–260	1, 4.4

Table 1. Details of the References, Polymer Systems, Force Fields, and Computed Tg.