Insight into the role of excess hydroxide ions in silicate condensation reactions-Reference-Cited by-同舟云学术

Insight into the role of excess hydroxide ions in silicate condensation reactions

Published:2023 Issue:18 Volume:25 Page:12723-12733
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Do Tuong Ha¹,Tong Hien Duy²,Tran Khanh-Quang³,Meijer Evert Jan⁴^ORCID,Trinh Thuat T.⁵^ORCID

Affiliation:

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

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

3. Department of Energy and Process Engineering, Norwegian University of Science and Technology, Kolbjørn Hejes vei 1B, NO- 7491 Trondheim, Norway

4. Van 't Hoff Institute for Molecular Sciences, University of Amsterdam, Amsterdam, The Netherlands

5. Porelab, Department of Chemistry, Norwegian University of Science and Technology, Høgskoleringen 5, 7491-Trondheim, Norway

Abstract

This paper describes the formation of silicate species, from dimers to 4-membered rings, using ab initio molecular dynamics simulations in explicit water molecules with an excess hydroxide ion.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP00475A

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