material: Material definitions

Material class and related functions.

class daxs.utils.material.Material(a: float, b: float, c: float, alpha: float, beta: float, gamma: float, name: str | None = None)

Bases: object

__init__(a: float, b: float, c: float, alpha: float, beta: float, gamma: float, name: str | None = None) → None

Initialize a material with its unit cell parameters.

property volume: float

property s11: float

property s22: float

property s33: float

property s12: float

property s23: float

property s31: float

calculate_d_spacing(reflection: Iterable[int] = (1, 1, 1))

Calculate the d spacing for a given reflection.

classmethod from_name(name: str) → Material

Initialize a material from its name.

classmethod from_cif(filename: str) → Material

Initialize a material from a CIF file.