Real Space Exciton Wavefunction with SLEPC

[edward]

Dear Developers,

I've tried to plot exciton wavefunction in real space using the envelope function given by Slepc. But I got the error message as follows:

Code: Select all

[WARNING] Error reading SEC1 in ndb.BSS_diago, this can be due to the missing ndb.dipoles or ndb.ems1
[WARNING] BSE databases not found.

Would you mind giving me some instructions on tackling this issue?

Best,
Mingran

[Daniele Varsano]

Dear Mingran,

can you provide more information, e.g. posting your input/report files both BSE and ypp runs?

Best,
Daniele