10.6084/m9.figshare.11771112.v2
Yosuke Kanai
Yosuke
Kanai
Massively-Parallel Real-Time TDDFT Modules for Non-Equilibrium Electron Dynamics
figshare
2020
NSF-CSSI-2020-Poster
Computational Chemistry
2020-01-30 15:10:19
Poster
https://figshare.com/articles/poster/Massively-Parallel_Real-Time_TDDFT_Modules_for_Non-Equilibrium_Electron_Dynamics/11771112
Poster for 2020 NSF CSSI PI meeting.<div><br></div><div>Our goal is to build, test, and broadly disseminate new
software modules for the real-time time-dependent density functional theory
(RT-TDDFT) component in the massively parallel open-source Qb@ll code.<br></div>