New developments in SIESTA for high-performance materials simulations
Автор: MaX Centre of Excellence
Загружено: 2020-09-22
Просмотров: 2146
Описание:
The fifth Webinar of a series presenting the most recent developments of the MaX flagship codes entitled "New developments in SIESTA for high-performance materials simulations" took placed on 22 September 2020 at 15:00 CEST, featuring the SIESTA code.
In this webinar, we highlighted the performance enhancements and new features recently added to SIESTA within the MaX project, one of its flagship codes. The traditional high efficiency of the programme, stemming from its use of a finite-support atomic-orbital basis set, has been extended to leading-edge HPC systems by new solver options while its built-in subsystem for electronic transport (TranSIESTA), has undergone a major redesign for increased performance and functionality.
Download the webinar slides at http://max-centre.eu/webinar/new-deve...
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