Page 1 of 1

TDDFT

Posted: Mon Jan 09, 2012 2:10 pm
by fabienfontaine
Hi,
I would like to know if there is a keyword to specifiy the number of singlet or triplet TDDFT excitation energies since only at most 20 of them are printed
Thanks to the ABINIT community

Fabien Fontaine-Vive
Université de Nice

Re: TDDFT

Posted: Thu May 24, 2012 2:51 pm
by mverstra
looks like you want to change nexcitout in src/79_seqpar_mpi/tddft.F90