Diammoniosilane: Computational prediction of the thermodynamic properties of a potential chemical hydrogen storage system

Journal of Physical Chemistry A

Volumn 113, Issue 4, 2009, Pages 750-755

  Grant, Daniel J ^a   Arduengo III, Anthony J ^a   Dixon, David A ^a  

^a UNIVERSITY OF ALABAMA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC SPINS; ATOMIZATION ENERGIES; CCSD; COMPLETE BASIS SETS; COMPUTATIONAL PREDICTIONS; COUPLED-CLUSTER THEORIES; DEHYDROGENATION REACTIONS; ENDOTHERMIC REACTIONS; FIRST ORDERS; HEAT OF REACTIONS; HEATS OF FORMATIONS; HYDROGEN STORAGE SYSTEMS; INVERSION BARRIERS; METASTABLE SPECIES; MP2 LEVELS; SCALAR-RELATIVISTIC EFFECTS; Z LEVELS; ZERO-POINT ENERGIES;

BINDING ENERGY; CARBON NANOTUBES; COMPLEXATION; DEHYDROGENATION; HYDROGEN; HYDROGEN STORAGE; MOLECULES; SILANES; THERMODYNAMIC PROPERTIES;

SILICON;

EID: 63449107494     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp807870w     Document Type: Article

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