tRecX -- an environment for solving time-dependent Schr\"odinger-like problems
Abstract
TRecX is a C++ code for solving generalized inhomogeneous time-dependent Schr\"odinger-type equations in arbitrary dimensions and in a variety of coordinate systems. The operator may have simple non-linearities, as in Gross-Pitaevskii and Hartree(-Fock) problems. Primary application of tRecX has been non-perturbative strong-field single and double photo-electron emission in atomic and molecular physics. The code is designed for large-scale {\it ab initio} calculations, for exploring models, and for advanced teaching in computational physics. Distinctive numerical methods are the time-dependent surface flux method for the computation of single and double emission spectra and exterior complex scaling for absorption. Wave functions and operators are handled by tree-structures with the systematic use of recursion on the coarse-grain level. Numerical, analytic, and grid-based discretizations can be combined and are treated on the same abstract level. Operators are specified in the input using a script language including symbolic algebra. User-friendly in- and output, error safety, and documentation are integrated by design.
Cite
@article{arxiv.2101.08171,
title = {tRecX -- an environment for solving time-dependent Schr\"odinger-like problems},
author = {Armin Scrinzi},
journal= {arXiv preprint arXiv:2101.08171},
year = {2021}
}