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Rational Design and Targeted Synthesis of Small-Pore Zeolites with the Assistance of Molecular Modeling, Structural Analysis, and Synthetic Chemistry

Dan Xie
- 03 Nov 2021 - 
- Vol. 60, Iss: 43, pp 15403-15415
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This article is published in Industrial & Engineering Chemistry Research.The article was published on 2021-11-03 and is currently open access. It has received 5 citations till now. The article focuses on the topics: Rational design.

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Journal ArticleDOI

Structure Elucidation and Computationally Guided Synthesis of SSZ‐43: A One‐Dimensional 12‐Ring Zeolite with Unique Sinusoidal Channels

TL;DR: The structure of zeolite SSZ-43 was determined by 3D electron diffraction, synchrotron X-ray powder diffraction and high-resolution transmission electron microscopy as mentioned in this paper .
OtherDOI

1The Confluence of Organo‐Cations, Inorganic Species, and Molecular Modeling on the Discovery of New Zeolite Structures and Compositions

TL;DR: The use of organics in the synthesis gel creates additional opportunities for directing a specific zeolite structure, templating, space filling, and charge compensation, and the enormous variety of shapes and sizes of these organics can be both daunting and exciting as mentioned in this paper .
OtherDOI

1Co‐templating in the Designed Synthesis of Small‐pore Zeolite Catalysts

TL;DR: The potential of computational modeling in the design of organic structure directing agents (OSDAs) for target small-pore zeolites was demonstrated some three decades ago by the use of the ZEBEDDE program for an aluminophosphate zeotype with the CHA topology as discussed by the authors .
Journal ArticleDOI

Structure Elucidation and Computationally Guided Synthesis of SSZ‐43: A One‐Dimensional 12‐Ring Zeolite with Unique Sinusoidal Channels

TL;DR: The structure of zeolite SSZ-43 was determined by 3D electron diffraction, synchrotron X-ray powder diffraction and high-resolution transmission electron microscopy as discussed by the authors .
Journal ArticleDOI

Synthesis and crystal structure of a new RTH-type precursor and its interlayer expanded zeolite.

TL;DR: In this paper , a new layer silicate zeolite L was synthesized using the N, N-dimethyl-(2-methyl)-benzimidazolium as the structure-directing agent (SDA) under fluoride condition.
References
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Journal ArticleDOI

Control of zeolite framework flexibility and pore topology for separation of ethane and ethylene.

TL;DR: This material can kinetically separate ethylene from ethane with an unprecedented selectivity of ~100, owing to its distinctive pore topology with large heart-shaped cages and framework flexibility, which extends the boundaries for applicability of zeolites to challenging separations.
Patent

Zeolite SSZ-13 and its method of preparation

TL;DR: A crystalline zeolite, SSZ-13, was prepared from organic nitrogen-containing cations derived from 1-adamantamine, 3-quinuclidinol, and 2-exo-aminonorbornane as discussed by the authors.
Journal ArticleDOI

Issues in the synthesis of crystalline molecular sieves: towards the crystallization of low framework-density structures.

TL;DR: Synthesis mechanisms and the parameters that can direct the crystal assembly pathway and the ultimate product formed are discussed and rationalized.
Journal ArticleDOI

Needs and trends in rational synthesis of zeolitic materials

TL;DR: How the geometrical characteristics of zeolite frameworks affect the catalytic performances of the resulting materials is demonstrated and recent advances in synthetic innovations to target materials are presented.
Patent

Copper cha zeolite catalysts

TL;DR: In this article, the CHA crystal structure of zeolite catalysts has been described and a method for preparing and using them has been presented, which can be used to remove nitrogen oxides from a gaseous medium across a broad temperature range and exhibit hydrothermal stable at high reaction temperatures.