The Role of Chloride ion in the Silicate Condensation Reaction from ab Initio Molecular Dynamics Simulations-Reference-Cited by-同舟云学术

The Role of Chloride ion in the Silicate Condensation Reaction from ab Initio Molecular Dynamics Simulations

Published:2023-08-30 Issue:36 Volume:127 Page:7748-7757
ISSN:1520-6106
Container-title:The Journal of Physical Chemistry B
language:en
Short-container-title:J. Phys. Chem. B

Author:

Ho Thi H.¹²,Do Tuong Ha³,Tong Hien Duy⁴,Meijer Evert Jan⁵^ORCID,Trinh Thuat T.⁶^ORCID

Affiliation:

1. Laboratory for Computational Physics Institute for Computational Science and Artificial Intelligence, Van Lang University, Ho Chi Minh City 700000, Vietnam

2. Faculty of Mechanical - Electrical and Computer Engineering School of Technology, Van Lang University, Ho Chi Minh City 700000, Vietnam

3. Faculty of Applied Sciences, Ton Duc Thang University, 19 Nguyen Huu Tho, Tan Phong ward District 7, Ho Chi Minh City 700000, Vietnam

4. Faculty of Engineering, Vietnamese-German University (VGU), Thu Dau Mot City, Binh Duong Province 75000, Vietnam

5. Van ’t Hoff Institute for Molecular Sciences, University of Amsterdam, Amsterdam 1012 WX, The Netherlands

6. Porelab, Department of Chemistry, Norwegian University of Science and Technology, NO-7491 Trondheim, Norway

Funder

Norges Forskningsr?d

Universiteit van Amsterdam

Norges Teknisk-Naturvitenskapelige Universitet

Publisher

American Chemical Society (ACS)

Subject

Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcb.3c04256

Reference55 articles.

1. Speciation in Solution: Silicate Oligomers in Aqueous Solutions Detected by Mass Spectrometry

2. Where Are the Active Sites in Zeolites? Origin of Aluminum Zoning in ZSM-5

3. Effect of Al−Si−Al and Al−Si−Si−Al Pairs in the ZSM-5 Zeolite Framework on the 27Al NMR Spectra. A Combined High-Resolution 27Al NMR and DFT/MM Study

4. 29Si NMR and UV−Raman Investigation of Initial Oligomerization Reaction Pathways in Acid-Catalyzed Silica Sol−Gel Chemistry

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