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Issue Date
Title
Author(s)
2022-03
Insights into catalytic behavior of TiMgn (n=1–12) nanoclusters in hydrogen storage and dissociation process: A DFT investigation
Bandyopadhyay, Debashis
2023-02
First-Principal Study of the Effect of Ti Doping on Hydrogenation of Mgn (N=2-8) Nanoclusters
Bandyopadhyay, Debashis
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Author
2
Bandyopadhyay, Debashis
Subject
2
Physics
1
Activation barrier
1
B3LYP
1
Density Functional Theory (DFT)
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DOS/PDOS
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ELF
1
Physisorption and chemisorption
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Vertical electron affinity (VEA)
Date issued
1
2022
1
2023
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