Published November 16, 2024 | Version v1
Dataset Open

Coverage-Dependent Stability of RuxSiy on Ru(0001): A Comparative DFT and XPS Study

Creators

Contributors

  • 1. ROR icon Advanced Research Center for Nanolithography (Netherlands)
  • 2. ROR icon Leiden University
  • 3. ROR icon University of Amsterdam

Description

This repository contains the library of computational structures generated and used for our study "Coverage-dependent stability of RuxSiy on Ru(0001): a comparative DFT and XPS study" (https://doi.org/10.1039/D4CP04069D). The final processed data is compiled into a single ASE-compatible database file (https://wiki.fysik.dtu.dk/ase/ase/db/db.html), `RuSi-PCCP-Data.db`.

 

Files

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Additional details

Related works

Is supplement to
Publication: 10.1039/D4CP04069D (DOI)

Dates

Accepted
2024-11-16

References

  • Phys. Chem. Chem. Phys., 2024, 26, 28793