Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems

Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems

Real-space grids are a powerful alternative for the simulation of electronic systems. One of the main advantages of the approach is the flexibility and simplicity of working directly in real space where the different fields are discretized on a grid, combined with competitive numerical performance a...

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Bibliographic Details
Main Authors: Andrade, Xavier, De Giovannini, Umberto, Larsen, Ask Hjorth, Oliveira, Micael J. T., Alberdi-Rodriguez, Joseba, Varas, Alejandro, Theophilou, Iris, Helbig, Nicole, Verstraete, Matthieu J., Stella, Lorenzo, Nogueira, Fernando, Aspuru-Guzik, Alán, Castro, Alberto, Marques, Miguel A. L., Rubio, Angel, Strubbe, David Alan
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering
Format: Article
Published: Royal Society of Chemistry (RSC) 2018
Online Access:http://hdl.handle.net/1721.1/117777
https://orcid.org/0000-0003-2426-5532

Internet

http://hdl.handle.net/1721.1/117777
https://orcid.org/0000-0003-2426-5532

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