Nanoconfined water in magnesium-rich 2:1 Phyllosilicates

Journal of the American Chemical Society

Volumn 131, Issue 23, 2009, Pages 8155-8162

  Ockwig, Nathan W ^a   Greathouse, Jeffery A ^a   Durkin, Justin S ^a   Cygan, Randall T ^a   Daemen, Luke L ^b   Nenoff, Tina M ^a  

^a SANDIA NATIONAL LABORATORIES   (United States)

^b LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO MOLECULAR DYNAMICS; BOND DISTANCE; CLASSICAL MOLECULAR DYNAMICS; CO-ORDINATIVELY UNSATURATED; COMPLEMENTARY METHODS; DYNAMICAL BEHAVIORS; EDGE SITES; HYDROGEN BONDINGS; HYDROGEN-BONDING PATTERNS; LIBRATIONAL MODES; PALYGORSKITE; ROTATIONAL MOTION; SPECTROSCOPIC SIGNATURES; WATER INTERFACE;

BINDING SITES; CLAY MINERALS; DENSITY FUNCTIONAL THEORY; HYDROGEN; MAGNESIUM; MINERALS; MOLECULAR DYNAMICS; NEUTRON DIFFRACTION; NEUTRON SCATTERING; SILICATE MINERALS;

HYDROGEN BONDS;

ATTAPULGITE; HYDROGEN; MAGNESIUM; MAGNESIUM TRISILICATE; SILICATE; WATER;

AB INITIO CALCULATION; ARTICLE; CLAY; DENSITY FUNCTIONAL THEORY; HYDROGEN BOND; MOLECULAR DYNAMICS; NEUTRON SCATTERING; POROSITY; ROTATION; SPECTROSCOPY;

EID: 67650540767     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja900812m     Document Type: Article

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