Dynamics of confined reactive water in smectite clay-zeolite composites

Journal of the American Chemical Society

Volumn 134, Issue 6, 2012, Pages 3042-3053

  Pitman, Michael C ^a   Van Duin, Adri C T ^b  

^a IBM T J WATSON RESEARCH CENTER   (United States)

^b The Pennsylvania State University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ARRHENIUS; ATOMIC MODELS; BI-LAYER; CA-MONTMORILLONITE; CALCIUM HYDRATE; CLAY MODEL; CLAY SURFACES; COMPOSITE ENVIRONMENT; DIFFUSION OF WATER; ENHANCED OIL RECOVERY; FORCE FIELDS; GLOBAL SCALE; HYDRATION STRUCTURE; INNER SURFACES; MESOPOROUS; PREEXPONENTIAL FACTOR; PULSE FIELD GRADIENTS; REACTIVE FORCE FIELD; RESOURCE MANAGEMENT; SILANOLS; SILICALITE; SMECTITE PARTICLES; SMECTITES; SWELLING CLAY; TEMPERATURE DEPENDENCE; TEMPERATURE RANGE; WATER DYNAMICS; WATER LOADING;

ACTIVATION ENERGY; CALCIUM; CALCIUM SILICATE; DESALINATION; DYNAMICS; ENHANCED RECOVERY; GEOLOGIC MODELS; HYDRATES; HYDRATION; RADIOACTIVE WASTES; SURFACE CHEMISTRY; WATER FILTRATION;

CLAY MINERALS;

CALCIUM; MONTMORILLONITE; OIL; SILANOL; SILICON DIOXIDE; WATER; ZEOLITE;

ARTICLE; CLAY; COMPOSITE MATERIAL; DENSITY FUNCTIONAL THEORY; DIFFUSION; DYNAMICS; HYDRATION; MOLECULAR MODEL; PH; RADIOACTIVE WASTE DISPOSAL; RESOURCE MANAGEMENT; TEMPERATURE DEPENDENCE;

ALUMINUM SILICATES; CALCIUM; CHEMISTRY; DIFFUSION; HYDROGEN-ION CONCENTRATION; MAGNESIUM; MODELS, CHEMICAL; MODELS, MOLECULAR; MODELS, STATISTICAL; MOLECULAR CONFORMATION; SILICATES; SILICON DIOXIDE; TEMPERATURE; WATER; ZEOLITES;

EID: 84856876315     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja208894m     Document Type: Article

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