Inheritance diagram for qmworks.packages.dirac.DIRAC:
Collaboration diagram for qmworks.packages.dirac.DIRAC:
Public Member Functions | |
| def | __init__ (self) |
| def | prerun (self) |
| def | postrun (self) |
Static Public Member Functions | |
| def | run_job (settings, mol, job_name="dirac_job") |
| def | handle_special_keywords (settings, key, value, mol) |
Public Attributes | |
| generic_dict_file | |
Detailed Description
Member Function Documentation
◆ handle_special_keywords()
|
static |
Create the settings input for complex Dirac keywords
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The documentation for this class was generated from the following file:
- /home/docs/checkouts/readthedocs.org/user_builds/pyfragdocument/checkouts/latest/qmworks/packages/dirac.py
