Presentation Information

[18p-A23-2]Reaction pathway analysis and molecular design of ALD precursor using a universal machine learned force field

〇Yusuke Asano1 (1.Preferred Computational Chemistry)

Keywords:

ALD,reaction pathway analysis,molecular design

Atomic Layer Deposition (ALD) is a widely used process for forming metal thin films in semiconductor device fabrication. In this study, we analyze the surface chemical reaction mechanisms of ALD precursors using a universal machine-learned force field known as the PreFerred Potential. The insights gained from this analysis have led us to propose a method for more effective molecular design of ALD precursors.

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