Interatomic potentials for simulating MnO2 polymorphs

Molecular Simulation

Volumn 31, Issue 1, 2005, Pages 25-32

  Fleming, Sean D ^a   Morton, Jonathon R ^a   Rohl, Andrew L ^a   Ward, Chris B ^b  

^a CURTIN UNIVERSITY   (Australia)

^b HiTec Energy Ltd   (Australia)

Author keywords

Electrolytic manganese dioxide (EMD); Interatomic Potentials; Molecular modelling; Polymorphs

Indexed keywords

COULOMB BLOCKADE; CRYSTAL STRUCTURE; DATABASE SYSTEMS; DEFECTS; ELECTROCHEMISTRY; ELECTROLYSIS; ELECTROLYTIC ANALYSIS; INTERFACES (MATERIALS); LATTICE CONSTANTS;

ELECTROLYTIC MANGANESE DIOXIDE (EMD); INTERATOMIC POTENTIALS; MOLECULAR MODELING; MORSE POTENTIAL; POLYMORPHS;

MANGANESE COMPOUNDS;

EID: 11844287643     PISSN: 08927022     EISSN: None     Source Type: Journal    
DOI: 10.1080/08927020412331298702     Document Type: Article

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