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P. Austeria

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Oct 2026

Electronic and bonding origin of enhanced phase stability in layered 1T-MoSSe.

The layered material 1T-MoSSe demonstrates enhanced phase stability compared to pristine 1T-MoS2 and 1T-MoSe2. To understand the origin of this improved stability, first-principles calculations were employed, focusing on both electronic structure and bonding characteristics. An isomeric design concept was introduced by...

P. Austeria, P. V. Babu, S. Sampath · 0 citations

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