Hydrogen bonding in narrow protonated polymer electrolyte pores

Journal of Electroanalytical Chemistry

Volumn 660, Issue 2, 2011, Pages 347-351

  Ilhan, Mehmet A ^a   Spohr, Eckhard ^a,b  

^a UNIVERSITY OF DUISBURG ESSEN   (Germany)

^b Center for Computational Sciences and Simulations (CCSS)   (Germany)

Author keywords

Ab initio MD; CPMD; Hydrogen bond network structure; Polymer electrolytes; Proton transport

Indexed keywords

FUEL CELLS; MOLECULAR DYNAMICS; POLYELECTROLYTES; PROTONS;

AB INITIO; CAR-PARRINELLO MOLECULAR DYNAMICS; CONTACT ION PAIRS; CPMD; HYDROGEN BOND NETWORKS; HYDRONIUM IONS; LOW WATER-CONTENT; POLYMER ELECTROLYTES; PROTON TRANSPORT; PROTONATED POLYMERS; SULFONATE GROUPS; SULFONIC ACID GROUPS; WATER MOLECULE;

HYDROGEN BONDS;

EID: 80053127174     PISSN: 15726657     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jelechem.2011.03.035     Document Type: Article

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