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PyCrysFML08 Dictionaries List of PyCrysFML08 Functions cell_gls_type is an extension of cell_g_type . It can be created with function set_ crystal_cell . Key Value Description lcell ndarray ; dtype= int32 , shape=

cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . sett str | ndarray ; dtype = float32 , shape = ( 3,3 ) The setting change. It can be described by a string or by a ... Optional arguments. The keywords for the optional arguments are: matkind . matkind str The input matrix can be given as the S-matrix in ...

B_iso parameter cell dict Unit cell. It must be a dictionary of type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . r tuple The tuple returned by the function. r[0]

cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . cellb dict Unit cell. Dictionary of type cell_g_type or cell_gls_type . It can be generated with the function se

6 U values cell dict Unit cell. It must be a dictionary of type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . r tuple The tuple returned by the function. r[0]

Description cell dict Unit cell. It must be a dictionary of type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . tol float Angular tolerance in degrees. r tuple The

Beta values cell dict Unit cell. It must be a dictionary of type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . r tuple The tuple returned by the function. r[0]

6 B values cell dict Unit cell. It must be a dictionary of type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . r tuple The tuple returned by the function. r[0]

type cell_g_type or cell_gls_type . It can be generated with the function set_crystal_cell . spg dict The space group. It must be a dictionary of type spg_type . It can be generated with the function set_

vectors. spg dict Space group. It must be a dictionary of type spg_type or superspacegroup_type . It can be generated with the function set_spacegroup . mag bool True if magnetic scattering must be considered