pydft_qmmm.interfaces.psi4.psi4_utils

Functionality for setting Psi4 options and disabling logging.

Functions

disable_logging()	Disable Psi4 logging temporarily by directing output to null.
set_options(**options)	Set additional options for Psi4.

pydft_qmmm.interfaces.psi4.psi4_utils.disable_logging()

Disable Psi4 logging temporarily by directing output to null.

Return type:

None

pydft_qmmm.interfaces.psi4.psi4_utils.set_options(**options)

Set additional options for Psi4.

Parameters:

options (str | int | float | bool) – Additional options to provide to Psi4. See Psi4 options for additional Psi4 options.

Return type:

None