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Intrinsic Flexibility of the EMT Zeolite Framework Under Pressure

Antony Nearchou, Mero-Lee U. Cornelius, Jonathan M. Skelton, Zoe Jones, Andrew Cairns, Ines E. Collings, Paul R. Raithby, Stephen A. Wells, Asel Sartbaeva

Version 1 posted 16 January 2019

549

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Physical Chemistry

Working Paper

Intracrystalline Transport Barriers Affecting the Self-Diffusion of CH4 in Zeolites |Na12|-A and |Na12-xKx|-A

Niklas Hedin, Przemyslaw Rzepka, Alma Jasso-Salcedo, Tamara L. Church, Diana Bernin

Version 1 posted 14 December 2018

615

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Theoretical and Computational Chemistry

Working Paper

Inverse Design in Porous Materials Using Artificial Neural Networks

Baekjun Kim, Sangwon Lee, Jihan Kim

Version 1 posted 12 April 2019

1,206

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1

Citations

Materials Science

Working Paper

HPM-14, a New Germanosilicate Zeolite with Interconnected Extra-Large Pores Plus Odd-Membered and Small Pores

Zihao Gao, Jian Li, Cong Lin, Alvaro Mayoral, Junliang Sun, Miguel Camblor

Version 1 posted 21 April 2020

752

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Catalysis

Working Paper

Computational Insights into the Mechanism of the Selective Catalytic Reduction of NOx: Fe- Versus Cu-Doped Zeolite Catalysts

Julian Rudolph, Christoph R. Jacob

Version 2 posted 04 March 2019

1,193

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Inorganic Chemistry

Working Paper

Template Effects on the Pressure-Dependent Behavior of Chabazite-Type Fluoroaluminophosphates: A Computational Approach

Michael Fischer

Version 2 posted 22 October 2018

828

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1

Citations

Materials Science

Working Paper

Steering Polymer Growth by Molding Nanochannels: 1,5-Hexadiene Polymerization in High Silica Mordenite

Marco Fabbiani, Giorgia Confalonieri, sara morandi, Rossella Arletti, Simona Quartieri, Mario Santoro, Francesco Di Renzo, Julien Haines, Riccardo Fantini, gloria tabacchi, Ettore Fois, Giovanna Vezzalini, Gianmario Martra

Version 2 posted 30 April 2020

707

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Theoretical and Computational Chemistry

Working Paper

Porous Aluminophosphates as Adsorbents for the Separation of CO2/CH4 and CH4/N2 Mixtures – a Monte Carlo Simulation Study

Michael Fischer

Version 2 posted 29 May 2018

803

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Physical Chemistry

Working Paper

Pressure-Induced Symmetry Changes in Body-Centered Cubic Zeolites

Antony Nearchou, Mero-Lee Cornelius, Zoe Jones, Ines E. Collings, Stephen A. Wells, Paul R. Raithby, Asel Sartbaeva

Version 1 posted 13 December 2018

582

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Inorganic Chemistry

Working Paper

First-Principles Study of AlPO4-H3, a Hydrated Aluminophosphate Zeotype Containing Two Different Types of Adsorbed Water Molecules

Michael Fischer

Version 2 posted 28 February 2019

1,027

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69 results in Zeolites in Keywords: Zeolites

Intrinsic Flexibility of the EMT Zeolite Framework Under Pressure

Intracrystalline Transport Barriers Affecting the Self-Diffusion of CH4 in Zeolites |Na12|-A and |Na12-xKx|-A

Inverse Design in Porous Materials Using Artificial Neural Networks

HPM-14, a New Germanosilicate Zeolite with Interconnected Extra-Large Pores Plus Odd-Membered and Small Pores

Computational Insights into the Mechanism of the Selective Catalytic Reduction of NOx: Fe- Versus Cu-Doped Zeolite Catalysts

Template Effects on the Pressure-Dependent Behavior of Chabazite-Type Fluoroaluminophosphates: A Computational Approach

Steering Polymer Growth by Molding Nanochannels: 1,5-Hexadiene Polymerization in High Silica Mordenite

Porous Aluminophosphates as Adsorbents for the Separation of CO2/CH4 and CH4/N2 Mixtures – a Monte Carlo Simulation Study

Pressure-Induced Symmetry Changes in Body-Centered Cubic Zeolites

First-Principles Study of AlPO4-H3, a Hydrated Aluminophosphate Zeotype Containing Two Different Types of Adsorbed Water Molecules

69 results in Keywords: Zeolites