What governs the proton ordering in ice XV?

Journal of Physical Chemistry Letters

Volumn 4, Issue 18, 2013, Pages 3165-3169

  Nanda, Kaushik D ^a   Beran, Gregory J O ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

fragment methods; ice; molecular crystal; order disorder; polymorphism

Indexed keywords

ANTI FERROELECTRICS; COUPLED-CLUSTER THEORY; ELECTRONIC STRUCTURE CALCULATIONS; FRAGMENT METHOD; HYDROGEN BOND COOPERATIVITY; HYDROGEN BONDING INTERACTIONS; POWDER NEUTRON DIFFRACTION; SECOND ORDER PERTURBATION THEORY;

ELECTRONIC STRUCTURE; HYDROGEN BONDS; MOLECULAR CRYSTALS; ORDER DISORDER TRANSITIONS; POLYMORPHISM; PROTONS;

ICE;

EID: 84884567472     PISSN: None     EISSN: 19487185     Source Type: Journal    
DOI: 10.1021/jz401625w     Document Type: Article

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