Dear Xavier Rocquefelte
<https://www.mail-archive.com/search?l=wien@zeus.theochem.tuwien.ac.at&q=from:%22Xavier+Rocquefelte%22>
I have just modified as you said
...
read(4,*) screened
if ((screened .neqv. .true.) .and. (screened .neqv. .false.)) &
stop 'error in case.inhf: screening should be true or false'
if (screened .eqv. .true.) then
read(4,*) smu
if ((smu .lt. 1d-4) .or. (smu .gt. 5d0)) &
stop 'error in case.inhf: to avoid numerical instabilities, &
do not use lambda smaller than 0.0001 or larger than 5'
elseif (screened .eqv. .false.) then
* read(4,*) smu*
smu = 0d0
endif
....
but got same error. Thank you
==================================
Dear Tran,
I have just removed line to specify the screening lambda and got error
"error in read_weight: wrong case.weighhf"
How i can relsove this problem. I can ask you in my case nband = 34 i
right? Thank you.
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