[DFTB-Plus-User] vg-RTTDDFTB

luca.sementa at pi.ipcf.cnr.it luca.sementa at pi.ipcf.cnr.it
Tue Feb 20 09:39:56 CET 2024


Dear DFTB Developers

is there a DFTB release for simulating the electron dynamics in periodic 
systems like a 16x16x16 K-point mesh c-Si in 
doi.org/10.1021/acs.jctc.3c00689?

Best Regards.

Luca



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