Molecular dynamics simulation of microscopic structure and hydrogen bond network of the pristine and phosphoric acid doped polybenzimidazole

Polymer

Volumn 52, Issue 3, 2011, Pages 881-892

  Zhu, Suhua ^a   Yan, Liuming ^a   Zhang, Dongfang ^a   Feng, Qingxia ^a  

^a SHANGHAI UNIVERSITY   (China)

Author keywords

Hydrogen bonding network; Phosphoric acid; Polybenzimidazole

Indexed keywords

AROMATIC COMPOUNDS; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; OXYGEN; PHOSPHORIC ACID;

BONDING CHARACTERISTICS; COPLANAR CONFIGURATIONS; HYDROGEN BOND NETWORKS; HYDROGEN BONDING NETWORK; MOLECULAR DYNAMICS SIMULATIONS; PHOSPHORIC ACID DOPED POLYBENZIMIDAZOLE; POLYBENZIMIDAZOLE; UNITED ATOM FORCE FIELD;

HYDROGEN BONDS;

EID: 79551499988     PISSN: 00323861     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.polymer.2010.12.037     Document Type: Article

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