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Data · dataset · 2019

Data and code for "Strong plasmon-molecule coupling at the nanoscale revealed by first-principles modeling"

Listed in Researchdata.se

The data includes atomic structures, time-dependent dipole moments, and photoabsorption spectra of the systems modeled and analyzed in the article "Strong plasmon-molecule coupling at the nanoscale revealed by first-principles modeling" by Tuomas P. Rossi, Timur Shegai, Paul Erhart, and Tomasz J. Antosiewicz.

Description

The input scripts for reproducing the data are also included. The time-dependent density-functional theory calculations use the LCAOTDDFT module of the GPAW code, and the atomic structures are created with the ASE code.

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

Links

Where it is published

Catalogue records · 1

Topics

Inferred from text
Density functional theory 65%
Provenance · 1 source records, 8 field assertions
SourceKeyLast seenRaw
Researchdata.seoai:researchdata.se:doi-10-5281-zenodo-3242317/010 d agoJSON v1
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concepts[method].local:method:dftenrichment · researchdata sekeyword-concept-rules@1.0.0title+description (65%)
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