Coupled Maxwell and Time-Dependent Orbital Free Density Functional Calculations
| Autor: | Cody Covington, Justin Malave, Kalman Varga |
|---|---|
| Rok vydání: | 2020 |
| Předmět: |
Physics
Condensed Matter - Mesoscale and Nanoscale Physics Jellium FOS: Physical sciences 02 engineering and technology 021001 nanoscience & nanotechnology 01 natural sciences Molecular physics Electromagnetic radiation 0103 physical sciences Mesoscale and Nanoscale Physics (cond-mat.mes-hall) Physics::Atomic and Molecular Clusters SPHERES 010306 general physics 0210 nano-technology |
| DOI: | 10.48550/arxiv.2012.08008 |
| Popis: | Coupled Maxwell and time-dependent orbital-free calculations are implemented and tested to describe the interaction of electromagnetic waves and matter. The currents and induced fields predicted by the orbital-free calculations are compared to time-dependent density functional calculations and very good agreement is found for various systems including jellium sheets, jellium spheres, atomistic sheets, and icosahedron clusters. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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