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==ELK+Jefimenko== | ==ELK+Jefimenko== | ||
*[[Media:Elk+jefimenko_v1.zip|Download zip file]]. | *[[Media:Elk+jefimenko_v1.zip|Download zip file]]. | ||
*This is TDDFT package [https://elk.sourceforge.io/ ELK] extended to include computation of spin and charge currents | *This is time-dependent density functional theory (TDDFT) package [https://elk.sourceforge.io/ ELK] extended to include computation of spin and charge currents, as well as electromagnetic radiation by the latter via the Jefimenko solution of Maxwell equations in approximation where backaction of radiation onto its sources can be neglected. If you use our TDDFT+Jefimenko package to produce a scientific paper, you must cite in that paper: | ||
** A. Kefayati and B. K. Nikolić, ''Origins of electromagnetic radiation from spintronic terahertz emitters: A time-dependent density functional theory plus Jefimenko equations approach'', Phys. Rev. Lett. '''133''', 136704 (2024). [[Media:tddft_jefimenko_nipt.pdf|[PDF]]] | ** A. Kefayati and B. K. Nikolić, ''Origins of electromagnetic radiation from spintronic terahertz emitters: A time-dependent density functional theory plus Jefimenko equations approach'', Phys. Rev. Lett. '''133''', 136704 (2024). [[Media:tddft_jefimenko_nipt.pdf|[PDF]]] | ||
**J. K. Dewhurst, K. Krieger, S. Sharma, E. K. U. Gross, ''An efficient algorithm for time propagation as applied to linearized augmented plane wave method'', Comput. Phys. Commun. '''209''', 92 (2016). [https://doi.org/10.1016/j.cpc.2016.09.001 [PDF]] | **J. K. Dewhurst, K. Krieger, S. Sharma, E. K. U. Gross, ''An efficient algorithm for time propagation as applied to linearized augmented plane wave method'', Comput. Phys. Commun. '''209''', 92 (2016). [https://doi.org/10.1016/j.cpc.2016.09.001 [PDF]] | ||
*If you need substantial help to start using it, you should also add helper from our group as the co-author. | *If you need substantial help to start using it, you should also add helper from our group as the co-author. | ||
Latest revision as of 10:49, 26 November 2024
ELK+Jefimenko
- Download zip file.
- This is time-dependent density functional theory (TDDFT) package ELK extended to include computation of spin and charge currents, as well as electromagnetic radiation by the latter via the Jefimenko solution of Maxwell equations in approximation where backaction of radiation onto its sources can be neglected. If you use our TDDFT+Jefimenko package to produce a scientific paper, you must cite in that paper:
- A. Kefayati and B. K. Nikolić, Origins of electromagnetic radiation from spintronic terahertz emitters: A time-dependent density functional theory plus Jefimenko equations approach, Phys. Rev. Lett. 133, 136704 (2024). [PDF]
- J. K. Dewhurst, K. Krieger, S. Sharma, E. K. U. Gross, An efficient algorithm for time propagation as applied to linearized augmented plane wave method, Comput. Phys. Commun. 209, 92 (2016). [PDF]
- If you need substantial help to start using it, you should also add helper from our group as the co-author.
