WaveMixings.jl: a Julia package for performing on-the-fly time-resolved nonlinear electronic spectra from quasi-classical trajectories
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arXiv
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| Autores principales: | , , , , , |
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| Formato: | Preprint |
| Publicado: |
2025
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| Acceso en línea: | |
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| _version_ | 1866908518966099968 |
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| author | Vasquez, Luis Pios, Sebastian Chen, Lipeng Lan, Zhenggang Domcke, Wolfgang Gelin, Maxim |
| author_facet | Vasquez, Luis Pios, Sebastian Chen, Lipeng Lan, Zhenggang Domcke, Wolfgang Gelin, Maxim |
| contents | We present an efficient numerical implementation of the quasi-classical doorway-window approximation, specifically designed for on-the-fly simulations of time-resolved nonlinear spectroscopic signals in the Julia package WaveMixings.jl. The package contains modules that facilitate standard tasks such as input/output data handling, data filtering, and post-processing, among others. WaveMixings.jl includes implementations of various methods developed by the authors, including integral and dispersed transient absorption pump-probe signals and two-dimensional spectra. By developing WaveMixings.jl we aim to create a versatile platform to perform simulations and develop methodologies within the quasi-classical doorway-window approximation framework. |
| format | Preprint |
| id |
arxiv_https___arxiv_org_abs_2509_03917 |
| institution | arXiv |
| publishDate | 2025 |
| record_format | arxiv |
| spellingShingle | WaveMixings.jl: a Julia package for performing on-the-fly time-resolved nonlinear electronic spectra from quasi-classical trajectories Vasquez, Luis Pios, Sebastian Chen, Lipeng Lan, Zhenggang Domcke, Wolfgang Gelin, Maxim Chemical Physics Optics We present an efficient numerical implementation of the quasi-classical doorway-window approximation, specifically designed for on-the-fly simulations of time-resolved nonlinear spectroscopic signals in the Julia package WaveMixings.jl. The package contains modules that facilitate standard tasks such as input/output data handling, data filtering, and post-processing, among others. WaveMixings.jl includes implementations of various methods developed by the authors, including integral and dispersed transient absorption pump-probe signals and two-dimensional spectra. By developing WaveMixings.jl we aim to create a versatile platform to perform simulations and develop methodologies within the quasi-classical doorway-window approximation framework. |
| title | WaveMixings.jl: a Julia package for performing on-the-fly time-resolved nonlinear electronic spectra from quasi-classical trajectories |
| topic | Chemical Physics Optics |
| url | https://arxiv.org/abs/2509.03917 |