Investigating the adsorption performance of CO 2 , SO 2 , NH 3 and CH 4 molecules on Sb 3 (TM)O 6 (TM = Sc, Ti, V, Cr, Mn, Fe, Ni, and Co) clusters for gas-sensing applications

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Authors: Nimra Zaib Raza, Abdul Majid, Sajjad Haider, Kamran Alam
Cited by: 7
References: 57

Abstract

gases is calculated. The properties and charge analysis of fully loaded clusters are studied through quantum topology of atoms in molecule (QTAIM) and charge-transfer integrals.

Fields of Study & Subjects

Gas Sensing Nanomaterials and Sensors Catalysis and Oxidation Reactions Metal-Organic Frameworks: Synthesis and Applications

Publication details

Journal / source
RSC Advances
Publisher
Royal Society of Chemistry (RSC)
Volume
16
Issue
7
Pages
6164–6188
Publication date
1 January 2026
Language
EN