The CP2K project : input section WFN_FITTING
Section
WFN_FITTING
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WFN_FITTING
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Parameters needed to set wavefunction fitting. This section can not be repeated and can not be optional.
Subsections
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Section keywords
METHOD
Keyword descriptions
METHOD
METHOD BASIS_SET_FIT
Method that shall be used for wavefunction fitting
This optional keyword expects a keyword. Default value: BASIS_SET_FIT
valid keywords:
BASIS_SET_FIT
: Fit wavefunction using AUX_BASIS_FIT
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