Gas phase dissociation of H2SO4: A computational study

Journal of Chemical Thermodynamics

Volumn 38, Issue 11, 2006, Pages 1292-1300

  Brutti, S ^a   Bencivenni, L ^a   Barbarossa, V ^b   Sau, S ^b   Maria, G De ^a  

^a SAPIENZA UNIVERSITY OF ROME   (Italy)

^b ENEA C R CASACCIA   (Italy)

Author keywords

Ab initio calculations; Enthalpy of formation; Gaseous sulfuric acid; Thermodynamic function calculations; Thermodynamic modeling

Indexed keywords

COMPLEXATION; CRYSTAL STRUCTURE; DECOMPOSITION; DISSOCIATION; GROUND STATE; PERTURBATION TECHNIQUES;

AB INITIO CALCULATIONS; ENTHALPY OF FORMATION; GASEOUS SULFURIC ACID; THERMODYNAMIC FUNCTION CALCULATIONS; THERMODYNAMIC MODELING;

SULFURIC ACID;

EID: 33749254939     PISSN: 00219614     EISSN: 10963626     Source Type: Journal    
DOI: 10.1016/j.jct.2006.02.009     Document Type: Article

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