Chemical Data Processing Library Python API - Version 1.4.0
Static Public Attributes | List of all members
CDPL.Grid.ControlParameterDefault Class Reference

Provides default values for built-in control-parameters. More...

+ Inheritance diagram for CDPL.Grid.ControlParameterDefault:

Static Public Attributes

bool STRICT_ERROR_CHECKING = False
 Default setting (= False) for the control-parameter Grid.ControlParameter.STRICT_ERROR_CHECKING.
 
bool CDF_OUTPUT_SINGLE_PRECISION_FLOATS = True
 Default setting (= False) for the control-parameter Grid.ControlParameter.CDF_OUTPUT_SINGLE_PRECISION_FLOATS. More...
 
bool CUBE_COMMENT_IS_NAME = False
 Default setting (= False) for the control-parameter Grid.ControlParameter.CUBE_COMMENT_IS_NAME. More...
 
float CUBE_INPUT_DISTANCE_SCALING_FACTOR = 0.52918
 Default setting for the control-parameter Grid.ControlParameter.CUBE_INPUT_DISTANCE_SCALING_FACTOR. More...
 
float CUBE_OUTPUT_DISTANCE_SCALING_FACTOR = 1.8897161646320724
 Default setting for the control-parameter Grid.ControlParameter.CUBE_OUTPUT_DISTANCE_SCALING_FACTOR. More...
 

Detailed Description

Provides default values for built-in control-parameters.

Member Data Documentation

◆ CDF_OUTPUT_SINGLE_PRECISION_FLOATS

bool CDPL.Grid.ControlParameterDefault.CDF_OUTPUT_SINGLE_PRECISION_FLOATS = True
static

Default setting (= False) for the control-parameter Grid.ControlParameter.CDF_OUTPUT_SINGLE_PRECISION_FLOATS.

Since
1.2

◆ CUBE_COMMENT_IS_NAME

bool CDPL.Grid.ControlParameterDefault.CUBE_COMMENT_IS_NAME = False
static

Default setting (= False) for the control-parameter Grid.ControlParameter.CUBE_COMMENT_IS_NAME.

Since
1.4

◆ CUBE_INPUT_DISTANCE_SCALING_FACTOR

float CDPL.Grid.ControlParameterDefault.CUBE_INPUT_DISTANCE_SCALING_FACTOR = 0.52918
static

Default setting for the control-parameter Grid.ControlParameter.CUBE_INPUT_DISTANCE_SCALING_FACTOR.

The default value (= 1/0.52918) performs a conversion from Bohr to Angstrom.

Since
1.4

◆ CUBE_OUTPUT_DISTANCE_SCALING_FACTOR

float CDPL.Grid.ControlParameterDefault.CUBE_OUTPUT_DISTANCE_SCALING_FACTOR = 1.8897161646320724
static

Default setting for the control-parameter Grid.ControlParameter.CUBE_OUTPUT_DISTANCE_SCALING_FACTOR.

The default value (= 0.52918) performs a conversion from Angstrom to Bohr.

Since
1.4