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20172022
most citedLattice instability, anharmonicity and Raman spectra of BaO under high pressure: A first principles study

5 citations · 5 across the 3 of their papers we have counts for

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Showing 2018 · cond-mat.mtrl-sciShow all

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cond-mat.mtrl-sci2018

First principles study on small ZrAln and HfAln clusters: structural, stability, electronic states and CO2 adsorption

Hardik L. Kagdada, Shweta D. Dabhi, Venu Mankad +2

We report a first principles study based on density functional theory on the structural and electronic properties of transition metal Zr and Hf doped small aluminum clusters with 1…