Class MultipoleSubTab

PyQt4.QtCore.QObject --+    
                       |    
              BaseSubTab --+
                           |
                          MultipoleSubTab

This sub tab class is used for Multipole property.

Instance Methods

[hide private]

dict

getMmJagKeywords(self, checked)
This function returns dictionary of mmjag keywords for this sub tab.

loadSettings(self, keywords)
This function restores this sub tab from the keywords dictionary.

theoryUpdated(self, theory_level, dft_functional, spin_treatment, basis)
FIXME

Inherited from BaseSubTab: __init__, setup

Instance Variables

[hide private]

Inherited from BaseSubTab: row_id, spin, theory_level, ui

Method Details

[hide private]

getMmJagKeywords(self, checked)

This function returns dictionary of mmjag keywords for this sub tab. It is only used for tabs that don't have options.

Parameters:

checked - True if property row is 'checked'

Returns: dict

mmjag keywords dictionary

Overrides: BaseSubTab.getMmJagKeywords

(inherited documentation)

loadSettings(self, keywords)

This function restores this sub tab from the keywords dictionary.

Parameters:

keywords - mmjag keywrods dictionary

Overrides: BaseSubTab.loadSettings

(inherited documentation)

theoryUpdated(self, theory_level, dft_functional, spin_treatment, basis)

FIXME

Parameters:

theory - The current level of theory. Must be one of "DFT", "HF" or "LMP2"
dft_functional - If c{theory} is "DFT", the currently selected functional level. If theory is not "DFT" or if the user has not specified a functional level, should be None.
spin_unrestricted - Whether the spin-unrestricted check box is checked in the theory tab. If theory is "LMP2", should be None.
basis - The currently selected basis set without the polarization or diffuse levels (i.e. "6-31G" rather than "6-31G**+")

Overrides: BaseSubTab.theoryUpdated