Abstract
The amorphous state of poly (Narylenebenzimidazole ketone)(PNABIK) were determined using the Amorphous Cell Module of the Materials Studio program. The solubility improvement of PNABIK compared with traditional ploybenzimidazole (PBI) was also simulated by cohesive energy density (CED) calculating. PNABIK was synthesized by N-C coupling reaction to validate the rationality of simulation results and all the simulation results were consistent with the experimental tests.
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