Jamal Abdul Nasir

8PUBLICATIONS
19CO-AUTHORS
PyrometallurgyMetal organic frameworksTransition metal chemistryTheoretical quantum chemistryComputational chemistry
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Publications (8)

|Aug 04, 2026
Formation, structure and dynamics of hydroxyl nest defects in zeolites.

|Sep 02, 2025
Modelling silica using MACE-MP machine learnt interatomic potentials.

Jamal Abdul Nasir, Jingcheng Guan, Woongkyu Jee

|Oct 23, 2024
Understanding deNO mechanisms in transition metal exchanged zeolites.

Jamal Abdul Nasir, Andrew M Beale, C Richard A Catlow

|May 21, 2023
Computational infrared and Raman spectra by hybrid QM/MM techniques: a study on molecular and catalytic material systems.

Jingcheng Guan, You Lu, Kakali Sen

|Apr 25, 2023
Multiscale QM/MM modelling of catalytic systems with ChemShell.

You Lu, Kakali Sen, Chin Yong

|Dec 22, 2022
Influence of Solvent on Selective Catalytic Reduction of Nitrogen Oxides with Ammonia over Cu-CHA Zeolite.

Jamal Abdul Nasir, Jingcheng Guan, Thomas W Keal

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Frequent Collaborators

6 joint publications

C Richard A Catlow

4 joint publications

Thomas W Keal

4 joint publications

Alexey A Sokol

3 joint publications

Andrew M Beale