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Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems.
Tancogne-Dejean N, Oliveira MJT, Andrade X, Appel H, Borca CH, Le Breton G, Buchholz F, Castro A, Corni S, Correa AA, De Giovannini U, Delgado A, Eich FG, Flick J, Gil G, Gomez A, Helbig N, Hübener H, Jestädt R, Jornet-Somoza J, Larsen AH, Lebedeva IV, Lüders M, Marques MAL, Ohlmann ST, Pipolo S, Rampp M, Rozzi CA, Strubbe DA, Sato SA, Schäfer C, Theophilou I, Welden A, Rubio A. Tancogne-Dejean N, et al. Among authors: eich fg. J Chem Phys. 2020 Mar 31;152(12):124119. doi: 10.1063/1.5142502. J Chem Phys. 2020. PMID: 32241132 Free article.
Kinetic-Energy Density-Functional Theory on a Lattice.
Theophilou I, Buchholz F, Eich FG, Ruggenthaler M, Rubio A. Theophilou I, et al. Among authors: eich fg. J Chem Theory Comput. 2018 Aug 14;14(8):4072-4087. doi: 10.1021/acs.jctc.8b00292. Epub 2018 Jul 19. J Chem Theory Comput. 2018. PMID: 29969552 Free PMC article.
Time-Dependent Magnons from First Principles.
Tancogne-Dejean N, Eich FG, Rubio A. Tancogne-Dejean N, et al. Among authors: eich fg. J Chem Theory Comput. 2020 Feb 11;16(2):1007-1017. doi: 10.1021/acs.jctc.9b01064. Epub 2020 Jan 28. J Chem Theory Comput. 2020. PMID: 31922758 Free PMC article.
Transient Charge and Energy Flow in the Wide-Band Limit.
Covito F, Eich FG, Tuovinen R, Sentef MA, Rubio A. Covito F, et al. Among authors: eich fg. J Chem Theory Comput. 2018 May 8;14(5):2495-2504. doi: 10.1021/acs.jctc.8b00077. Epub 2018 Apr 30. J Chem Theory Comput. 2018. PMID: 29660278 Free PMC article.
Functional theories of thermoelectric phenomena.
Eich FG, Di Ventra M, Vignale G. Eich FG, et al. J Phys Condens Matter. 2017 Feb 15;29(6):063001. doi: 10.1088/1361-648X/29/6/063001. Epub 2016 Dec 19. J Phys Condens Matter. 2017. PMID: 27991434
Density-functional theory of thermoelectric phenomena.
Eich FG, Di Ventra M, Vignale G. Eich FG, et al. Phys Rev Lett. 2014 May 16;112(19):196401. doi: 10.1103/PhysRevLett.112.196401. Epub 2014 May 14. Phys Rev Lett. 2014. PMID: 24877951
12 results