Chalmers University of Technology, Department of Physics
Published September 30, 2022 | Version 1
Software Open

Code for "Hot-carrier transfer across a nanoparticle-molecule junction: The importance of orbital hybridization and level alignment"

Creators

  • 1. Chalmers University of Technology, Sweden
  • 2. Aalto University, Finland
  • 3. Technical University of Denmark

Description

This upload includes the codes and input scripts for reproducing the analysis presented in the article "Hot-carrier transfer across a nanoparticle-molecule junction: The importance of orbital hybridization and level alignment" by Jakub Fojt, Tuomas P. Rossi, Mikael Kuisma, and Paul Erhart.

The codes reproduce the data of the article provided at doi:10.5281/zenodo.6524101

See README.md in the upload for a detailed description.

Files

code.zip

Files (51.1 kB)

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Additional details

Related works

Is supplement to
Dataset: 10.5281/zenodo.6524101 (DOI)
Journal article: 10.1021/acs.nanolett.2c02327 (DOI)

Funding

Plasmonic nanocatalysts for a sustainable future (PLASMOCAT) 332429
Academy of Finland
RealNanoPlasmon – Towards nanoscale reality in plasmonic hot-carrier generation 838996
European Commission