mirror of
https://github.com/LCPQ/quantum_package
synced 2024-12-22 20:35:19 +01:00
-p option for pseudos OK
This commit is contained in:
parent
8fab38fcc0
commit
92209e7df9
@ -64,10 +64,10 @@ let run ?o b c m p xyz_file =
|
||||
let command =
|
||||
if (p) then
|
||||
Qpackage.root ^ "/scripts/get_basis.sh \"" ^ temp_filename
|
||||
^ "\" \"" ^ basis ^"\""
|
||||
^ "\" \"" ^ basis ^"\" pseudo"
|
||||
else
|
||||
Qpackage.root ^ "/scripts/get_basis.sh \"" ^ temp_filename
|
||||
^ "\" \"" ^ basis ^"\" pseudo"
|
||||
^ "\" \"" ^ basis ^"\""
|
||||
in
|
||||
begin
|
||||
let filename =
|
||||
|
Loading…
Reference in New Issue
Block a user