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

integration_instructionsResearch softwarekeyboard_double_arrow_right Software 30 Sep 2022Publisher:ZenodoFunded by:AKA | Plasmonic nanocatalysts f..., EC | RealNanoPlasmon, kawforskning | unidentified +2 projects

Authors: Fojt, Jakub; Rossi, Tuomas; Kuisma, Mikael; Erhart, Paul;

doi: 10.5281/zenodo.7118376 , 10.5281/zenodo.7118377

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

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Abstract

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.

Related Organizations

Chalmers University of Technology
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Aalto University
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Technical University of Denmark
Denmark

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