Hydrogen-bonding networks from first-principles: Exploring the guanidine crystal

Journal of Physical Chemistry A

Volumn 116, Issue 18, 2012, Pages 4551-4559

  Hoepfner, Veronika ^a   Deringer, Volker L ^a   Dronskowski, Richard ^a  

^a RWTH AACHEN UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL APPROACH; COOPERATIVE INTERACTIONS; HYDROGEN BONDED NETWORK; HYDROGEN BONDING NETWORK; IONIC SOLIDS; LAYERED STRUCTURES; ORGANIC CHEMISTRY; PLANE WAVE; SUPERCELL TECHNIQUE; ZERO-DIMENSIONAL;

HYDROGEN; HYDROGEN BONDS;

MOLECULAR CRYSTALS;

GUANIDINE; HYDROGEN;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; CRYSTALLIZATION; DIMERIZATION; HYDROGEN BOND; QUANTUM THEORY; THERMODYNAMICS; X RAY CRYSTALLOGRAPHY;

CRYSTALLIZATION; CRYSTALLOGRAPHY, X-RAY; DIMERIZATION; GUANIDINE; HYDROGEN; HYDROGEN BONDING; MODELS, CHEMICAL; QUANTUM THEORY; THERMODYNAMICS;

EID: 84861064990     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp2106132     Document Type: Article

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