mirror of
https://github.com/cp2k/cp2k.git
synced 2026-07-28 14:15:19 -04:00
clarify print of spectrum files
This commit is contained in:
parent
66f2d5c54d
commit
95aecd4ddd
1 changed files with 4 additions and 4 deletions
|
|
@ -364,10 +364,10 @@ CONTAINS
|
|||
|
||||
IF (unit_nr > 0) THEN
|
||||
WRITE (unit_nr, '(T2,A4)') 'BSE|'
|
||||
WRITE (unit_nr, '(T2,A4,T7,A50,A)') &
|
||||
'BSE|', "Printed optical absorption spectrum to local file ", file_name_spectrum
|
||||
WRITE (unit_nr, '(T2,A4,T7,A44,A)') &
|
||||
'BSE|', "as well as photoabsorption cross section to ", file_name_crosssection
|
||||
WRITE (unit_nr, '(T2,A4,T7,A,A)') &
|
||||
'BSE|', "Printed optical absorption spectrum to local files, e.g. ", file_name_spectrum
|
||||
WRITE (unit_nr, '(T2,A4,T7,A,A)') &
|
||||
'BSE|', "as well as photoabsorption cross section to, e.g. ", file_name_crosssection
|
||||
WRITE (unit_nr, '(T2,A4,T7,A52)') &
|
||||
'BSE|', "using the Eq. (7.51) from C. Ullrichs Book on TDDFT:"
|
||||
WRITE (unit_nr, '(T2,A4)') 'BSE|'
|
||||
|
|
|
|||
Loading…
Add table
Add a link
Reference in a new issue