The XTermKind function

[sdwang]

Dear all,
I noticed there is a option in the input file 'XTermKind' for the response calculation. Does it work as 'GTermKind' now?

Thanks!

Shudong

[Daniele Varsano]

Dear Shudong,
the terminators' technique for accelerating convergence on empty bands are both implemented for the response function X (XTermKind) and GW summation (GTermKind).
In order to activate them, it is needed to add verbosity in the generation of the input file.

Code: Select all

 "-V resp"

for XTermKind

Code: Select all

"-V qp"

for GTermKind

As usual, using

Code: Select all

"-V all"

you have all the auxiliary variables not set by default.

Best,
Daniele