Large-scale atomistic and quantum-mechanical simulations of a Nafion membrane: Morphology, proton solvation and charge transport

Erstveröffentlichung

2013

Authors

Komarov, Pavel V.

Khalatur, Pavel G.

Khokhlov, Alexei R.

Wissenschaftlicher Artikel

Published in

Beilstein journal of nanotechnology ; 4 (2013). - S. 567-587. - ISSN 2190-4286

Link to publication

https://dx.doi.org/10.3762/bjnano.4.65

Faculties

Fakultät für Naturwissenschaften

Institutions

Institute of Advanced Energy-Related Nanomaterials

Subject headings

[Free subject headings]: atomistic simulation | morphology | Nafion membrane | proton transport | quantum molecular dynamics | MOLECULAR-DYNAMICS SIMULATIONS | POLYMER ELECTROLYTE MEMBRANES | PERFLUOROSULFONIC ACID MEMBRANE | CONCENTRATED SALT-SOLUTIONS | WATER-CONTAINING NAFION | X-RAY-ABSORPTION | ab-initio | STRUCTURAL ORGANIZATION | MESOSCALE SIMULATION | COMPUTER-SIMULATION
[DDC subject group]: DDC 530 / Physics | DDC 620 / Engineering & allied operations

Metadata

Show full item record