(magnetic_spglib_dataset)= # Magnetic Spglib dataset (Experimental) **New at version 2.0** The dataset is accessible through the C-structure given by ```c typedef struct { /* Magnetic space-group type */ int uni_number; int msg_type; int hall_number; int tensor_rank; /* Magnetic symmetry operations */ int n_operations; int (*rotations)[3][3]; double (*translations)[3]; int *time_reversals; /* Equivalent atoms */ int n_atoms; int *equivalent_atoms; /* Transformation to standardized setting */ double transformation_matrix[3][3]; double origin_shift[3]; /* Standardized crystal structure */ int n_std_atoms; double std_lattice[3][3]; int *std_types; double (*std_positions)[3]; double *std_tensors; double std_rotation_matrix[3][3]; /* Intermidiate datum in symmetry search */ double primitive_lattice[3][3]; } SpglibMagneticDataset; ``` ## Magnetic space-group type ### `uni_number` The serial number from 1 to 1651 of UNI or BNS symbols. ### `msg_type` Magnetic space groups (MSG) is classified by its family space group (FSG) and maximal space subgroup (XSG). FSG is a non-magnetic space group obtained by ignoring time-reversal term in MSG. XSG is a space group obtained by picking out non time-reversal operations in MSG. - `msg_type==1` (type-I): MSG, XSG, FSG are all isomorphic. - `msg_type==2` (type-II): XSG and FSG are isomorphic, and MSG is generated from XSG and pure time reversal operations - `msg_type==3` (type-III): XSG is a proper subgroup of MSG with isomorphic translational subgroups. - `msg_type==4` (type-IV): XSG is a proper subgroup of MSG with isomorphic point group. ### `hall_number` For type-I, II, III, {ref}`hall number ` of FSG; for type-IV, that of XSG ### `tensor_rank` 0 for collinear spins, 1 for non-collinear spins ## Magnetic symmetry operations ### `n_operations` Number of magnetic symmetry operations. ### `rotations` Rotation (matrix) parts of symmetry operations ### `translations` Translation (vector) parts of symmetry operations ### `time_reversals` Time reversal part of magnetic symmetry operations. 1 indicates time reversal operation, and 0 indicates an ordinary operation. ## Symmetrically equivalent atoms ### `n_atoms` and `equivalent_atoms` See {ref}`spglib_dataset_equivalent_atoms`. ## Transformation to standardized setting ### `transformation_matrix` and `origin_shift` See {ref}`dataset_origin_shift_and_transformation`. ## Standardized crystal structure after idealization ### `n_std_atoms`, `std_lattice`, `std_types`, `std_positions`, and `std_rotation_matrix` See {ref}`dataset_idealized_cell`. ### `std_tensors` Site tensors of the standardized crystal structure {ref}`idealization `. ## Intermediate data in symmetry search ### `primitive_lattice` See {ref}`spglib_dataset_primitive_lattice`.