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Takat B. Rawal

4 results in Authors: Takat B. Rawal

Theoretical and Computational Chemistry

Syngas Molecules as Probes for Defects In 2D Hexagonal Boron Nitride: their Adsorption and Vibrations

Tao Jiang, Duy Le, Takat B. Rawal, Talat S. Rahman

Version 1 posted 30 November 2020

327

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Materials Science

Generation of Thermodynamically Favorable Crystal Structures of Pb_{10-x}Cu_x(PO4)6O using Atom Combinatorics Approach

Vaidish Sumaria, Takat B. Rawal, David Sommer, Jake Vikoren, Young Feng Li, Deeptanshu (Deep) Prasad

Version 1 posted 08 September 2023

529

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Physical Chemistry

Non-metal to metal transition of magnesia supported Au clusters affects the ultrafast dissociation dynamics of adsorbed CH3Br molecules

Mihai E. Vaida, Takat B. Rawal, Thorsten M. Bernhardt, Brett M. Marsh, Talat S. Rahman, Stephen R. Leone

Version 2 posted 11 April 2022

252

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Towards Higher Alcohol Formation using a single-layer MoS2 activated Au on Silica: Methanol Carbonylation to Acetaldehyde

Kortney Almeida, Katerina L. Chagoya, Alan Felix, Tao Jiang, Duy Le, Takat B. Rawal, Prescott E. Evans, Michelle Wurch, Koichi Yamaguchi, Peter A. Dowben, Ludwig Bartels, Talat S. Rahman, Richard G. Blair

Version 1 posted 29 April 2019

584

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