Massively-Parallel Real-Time TDDFT Modules for Non-Equilibrium Electron Dynamics Yosuke Kanai 10.6084/m9.figshare.11771115.v3 https://figshare.com/articles/poster/Massively-Parallel_Real-Time_TDDFT_Modules_for_Non-Equilibrium_Electron_Dynamics/11771115 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, to mitigate two most pressing limitations. 2020-02-14 19:38:02 NSF-CSSI-2020-Talk Computational Chemistry