Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites

doi:10.1002/anie.201908151

This content will become publicly available on September 30, 2020

Title: Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites

Authors:

^[1];

^[1]

Charles D. Davidson School of Chemical EngineeringPurdue University 480 Stadium Mall Drive West Lafayette IN 47907 USA

Publication Date:: 2019-11-11

Sponsoring Org.:: USDOE

OSTI Identifier:: 1567908

Grant/Contract Number:: [SC0010379]

Resource Type:: Publisher's Accepted Manuscript

Journal Name:: Angewandte Chemie (International Edition)

Additional Journal Information:: [Journal Name: Angewandte Chemie (International Edition) Journal Volume: 58 Journal Issue: 46]; Journal ID: ISSN 1433-7851

Publisher:: Wiley Blackwell (John Wiley & Sons)

Country of Publication:: Germany

Language:: English

Citation Formats


                    Bukowski, Brandon C., Bates, Jason S., Gounder, Rajamani, and Greeley, Jeffrey. Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites.  Germany: N. p., 2019. 
        Web.  doi:10.1002/anie.201908151.

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                    Bukowski, Brandon C., Bates, Jason S., Gounder, Rajamani, & Greeley, Jeffrey. Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites.  Germany.  doi:10.1002/anie.201908151.

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                    Bukowski, Brandon C., Bates, Jason S., Gounder, Rajamani, and Greeley, Jeffrey. Mon .  
        "Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites".  Germany.  doi:10.1002/anie.201908151.

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@article{osti_1567908,

  title        = {Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites},

  author       = {Bukowski, Brandon C. and Bates, Jason S. and Gounder, Rajamani and Greeley, Jeffrey},

  abstractNote = {},

  doi          = {10.1002/anie.201908151},

  journal      = {Angewandte Chemie (International Edition)},

  number       = [46],

  volume       = [58],

  place        = {Germany},

  year         = {2019},

  month        = {11}

}

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DOI: 10.1002/anie.201908151

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Similar Records

This content will become publicly available on September 30, 2020

Title: Defect‐Mediated Ordering of Condensed Water Structures in Microporous Zeolites

Citation Formats

Energetics: A New Field of Applications for Hydrophobic Zeolites journal, August 2001

Active Sites in Sn-Beta for Glucose Isomerization to Fructose and Epimerization to Mannose journal, May 2014

Thermodynamics of water intrusion in nanoporous hydrophobic solids journal, January 2008

Behavior of Water in the Hydrophobic Zeolite Silicalite at Different Temperatures. A Molecular Dynamics Study journal, May 2003

First principles, microkinetic, and experimental analysis of Lewis acid site speciation during ethanol dehydration on Sn-Beta zeolites journal, September 2018

Deconstructing the Confinement Effect upon the Organization and Dynamics of Water in Hydrophobic Nanoporous Materials: Lessons Learned from Zeolites journal, September 2017

Post-synthesis Snβ: An exploration of synthesis parameters and catalysis journal, October 2015

Superhydrophobic Carbon Nanotube Forests journal, December 2003

Beyond shape selective catalysis with zeolites: Hydrophobic void spaces in zeolites enable catalysis in liquid water journal, January 2013

Investigation of the reaction kinetics of isolated Lewis acid sites in Beta zeolites for the Meerwein–Ponndorf–Verley reduction of methyl levulinate to γ-valerolactone journal, December 2014

Grand Canonical Monte Carlo Simulation Study of Water Adsorption in Silicalite at 300 K journal, May 2008

Genesis and Stability of Hydronium Ions in Zeolite Channels journal, January 2019

The architecture of complex weighted networks journal, March 2004

Highly Porous, Homochiral Metal-Organic Frameworks: Solvent-Exchange-Induced Single-Crystal to Single-Crystal Transformations journal, March 2005

Distribution of open sites in Sn-Beta zeolite journal, June 2017

Voronoi polyhedra and Delaunay simplexes in the structural analysis of molecular-dynamics-simulated materials journal, June 1998

Dehydration Pathways of 1-Propanol on HZSM-5 in the Presence and Absence of Water journal, December 2015

The Effect of Local Defects on Water Adsorption in Silicalite-1 Zeolite: A Joint Experimental and Molecular Simulation Study journal, September 2007

Water-Soluble Single-Walled Carbon Nanotubes via Noncovalent Sidewall-Functionalization with a Pyrene-Carrying Ammonium Ion journal, June 2002

Dynamical behavior of one-dimensional water molecule chains in zeolites: Nanosecond time-scale molecular dynamics simulations of bikitaite journal, May 2004

Water in Carbon Nanotubes: The Peculiar Hydrogen Bond Network Revealed by Infrared Spectroscopy journal, August 2016

Tin-containing zeolites are highly active catalysts for the isomerization of glucose in water journal, March 2010

The behaviour of water confined in zeolites: molecular dynamics simulations versus experiment journal, June 2010

Water conduction through the hydrophobic channel of a carbon nanotube journal, November 2001

Highly Porous, Homochiral Metal-Organic Frameworks: Solvent-Exchange-Induced Single-Crystal to Single-Crystal Transformations journal, March 2005

Voronoi trees and clustering problems journal, January 1987

Deconstructing Hydrogen-Bond Networks in Confined Nanoporous Materials: Implications for Alcohol–Water Separation journal, August 2014

Determination of the catalytically active oxidation Lewis acid sites in Sn-beta zeolites, and their optimisation by the combination of theoretical and experimental studies journal, August 2005

Predicting the Activity of Single Isolated Lewis Acid Sites in Solid Catalysts journal, September 2006

Formation of ordered ice nanotubes inside carbon nanotubes journal, August 2001

Activation of Carbonyl-Containing Molecules with Solid Lewis Acids in Aqueous Media journal, October 2011

Energetics: A New Field of Applications for Hydrophobic Zeolites
journal, August 2001

Active Sites in Sn-Beta for Glucose Isomerization to Fructose and Epimerization to Mannose
journal, May 2014

Thermodynamics of water intrusion in nanoporous hydrophobic solids
journal, January 2008

Behavior of Water in the Hydrophobic Zeolite Silicalite at Different Temperatures. A Molecular Dynamics Study
journal, May 2003

First principles, microkinetic, and experimental analysis of Lewis acid site speciation during ethanol dehydration on Sn-Beta zeolites
journal, September 2018

Deconstructing the Confinement Effect upon the Organization and Dynamics of Water in Hydrophobic Nanoporous Materials: Lessons Learned from Zeolites
journal, September 2017

Post-synthesis Snβ: An exploration of synthesis parameters and catalysis
journal, October 2015

Superhydrophobic Carbon Nanotube Forests
journal, December 2003

Beyond shape selective catalysis with zeolites: Hydrophobic void spaces in zeolites enable catalysis in liquid water
journal, January 2013

Investigation of the reaction kinetics of isolated Lewis acid sites in Beta zeolites for the Meerwein–Ponndorf–Verley reduction of methyl levulinate to γ-valerolactone
journal, December 2014

Grand Canonical Monte Carlo Simulation Study of Water Adsorption in Silicalite at 300 K
journal, May 2008

Genesis and Stability of Hydronium Ions in Zeolite Channels
journal, January 2019

The architecture of complex weighted networks
journal, March 2004

Highly Porous, Homochiral Metal-Organic Frameworks: Solvent-Exchange-Induced Single-Crystal to Single-Crystal Transformations
journal, March 2005

Distribution of open sites in Sn-Beta zeolite
journal, June 2017

Voronoi polyhedra and Delaunay simplexes in the structural analysis of molecular-dynamics-simulated materials
journal, June 1998

Dehydration Pathways of 1-Propanol on HZSM-5 in the Presence and Absence of Water
journal, December 2015

The Effect of Local Defects on Water Adsorption in Silicalite-1 Zeolite: A Joint Experimental and Molecular Simulation Study
journal, September 2007

Water-Soluble Single-Walled Carbon Nanotubes via Noncovalent Sidewall-Functionalization with a Pyrene-Carrying Ammonium Ion
journal, June 2002

Dynamical behavior of one-dimensional water molecule chains in zeolites: Nanosecond time-scale molecular dynamics simulations of bikitaite
journal, May 2004

Water in Carbon Nanotubes: The Peculiar Hydrogen Bond Network Revealed by Infrared Spectroscopy
journal, August 2016

Tin-containing zeolites are highly active catalysts for the isomerization of glucose in water
journal, March 2010

The behaviour of water confined in zeolites: molecular dynamics simulations versus experiment
journal, June 2010

Water conduction through the hydrophobic channel of a carbon nanotube
journal, November 2001

Highly Porous, Homochiral Metal-Organic Frameworks: Solvent-Exchange-Induced Single-Crystal to Single-Crystal Transformations
journal, March 2005

Voronoi trees and clustering problems
journal, January 1987

Deconstructing Hydrogen-Bond Networks in Confined Nanoporous Materials: Implications for Alcohol–Water Separation
journal, August 2014

Determination of the catalytically active oxidation Lewis acid sites in Sn-beta zeolites, and their optimisation by the combination of theoretical and experimental studies
journal, August 2005

Predicting the Activity of Single Isolated Lewis Acid Sites in Solid Catalysts
journal, September 2006

Formation of ordered ice nanotubes inside carbon nanotubes
journal, August 2001

Activation of Carbonyl-Containing Molecules with Solid Lewis Acids in Aqueous Media
journal, October 2011