UDKM1DSIM – a Python toolbox for simulating 1D ultrafast dynamics in condensed matter

Published: 15 June 2021| Version 1 | DOI: 10.17632/bnzw823v6y.1


The udkm1Dsim toolbox is a collection of Python classes and routines to simulate the thermal, structural, and magnetic dynamics after laser excitation as well as the corresponding X-ray scattering response in one-dimensional samples, such as multilayers. The toolbox provides the capabilities to define arbitrary layered structures on the atomic level including a rich database of element-specific physical properties. The excitation of dynamics is represented by an N-temperature-model which is commonly applied in ultrafast physics. Structural dynamics due to thermal stresses are calculated by a linear-chain model of masses and springs. The implementation of specific magnetic dynamics can be easily accomplished by the user employing a generalized magnetization interface class. The resulting X-ray diffraction response is computed by kinematical or dynamical X-ray theory which can also include polarization-dependent magnetic scattering. The udkm1Dsim toolbox is highly modular and allows for injecting user-defined inputs at any step within the simulation procedure. The previous version of this program (AERH_v1_0) can be found at https://doi.org/10.1016/j.cpc.2013.10.009.



Condensed Matter Physics, Computational Physics, Structural Dynamics