moyopy._base

Classes

Cell
CollinearMagneticCell
NonCollinearMagneticCell
Operations
MagneticOperations

Module Contents

class moyopy._base.Cell(basis: list[list[float]], positions: list[list[float]], numbers: list[int])

property basis: list[list[float]]

property positions: list[list[float]]

property numbers: list[int]

property num_atoms: int

serialize_json() → str

Serialize the cell to a JSON string

classmethod deserialize_json(json_str: str) → Cell

Deserialize a JSON string to a Cell object

as_dict() → dict[str, Any]

Convert the cell to a dictionary

classmethod from_dict(data: dict[str, Any]) → Cell

Create a cell from a dictionary

class moyopy._base.CollinearMagneticCell(basis: list[list[float]], positions: list[list[float]], numbers: list[int], magnetic_moments: list[float])

property basis: list[list[float]]

property positions: list[list[float]]

property numbers: list[int]

property magnetic_moments: list[float]

property num_atoms: int

serialize_json() → str

Serialize the cell to a JSON string

classmethod deserialize_json(json_str: str) → Cell

Deserialize a JSON string to a Cell object

as_dict() → dict[str, Any]

Convert the cell to a dictionary

classmethod from_dict(data: dict[str, Any]) → Cell

Create a cell from a dictionary

class moyopy._base.NonCollinearMagneticCell(basis: list[list[float]], positions: list[list[float]], numbers: list[int], magnetic_moments: list[list[float]])

property basis: list[list[float]]

property positions: list[list[float]]

property numbers: list[int]

property magnetic_moments: list[list[float]]

property num_atoms: int

serialize_json() → str

Serialize the cell to a JSON string

classmethod deserialize_json(json_str: str) → Cell

Deserialize a JSON string to a Cell object

as_dict() → dict[str, Any]

Convert the cell to a dictionary

classmethod from_dict(data: dict[str, Any]) → Cell

Create a cell from a dictionary

class moyopy._base.Operations

property rotations: list[list[list[float]]]

property translations: list[list[float]]

property num_operations: int

__len__() → int

class moyopy._base.MagneticOperations

property rotations: list[list[list[float]]]

property translations: list[list[float]]

property time_reversals: list[bool]

property num_operations: int

__len__() → int