Dataset - Bridging chemistry and Gaussian boson sampling: A photonic hierarchy of approximations for molecular vibronic spectra

This dataset contains the data presented in the main article and supplementary information of the following paper:https://doi.org/10.48550/arXiv.2507.19442 It contains the molecule parameters (MolecularParameters.tar.gz) that are required for simulating vibronic spectra in the Franck-Condon approximation with the Duschinsky formalism.The optical parameters (OpticalParameters.tar.gz) are included as well, which are the parameters that could be used if one wants to simulate the vibronic spectra using the different approximations with the presented photonic approaches.All within the work simulated and measured vibronic spectra (VibronicSpectra.tar.gz) are available as well. The README.md contains more information on how the data is stored and can be accessed.本数据集包含下述论文的主文稿与补充材料中展示的全部数据：https://doi.org/10.48550/arXiv.2507.19442 其包含采用弗兰克-康登近似（Franck-Condon approximation）结合杜申斯基形式主义（Duschinsky formalism）模拟振动态光谱所需的分子参数压缩包（MolecularParameters.tar.gz）。此外还附带光学参数压缩包（OpticalParameters.tar.gz），该类参数可用于基于本文提出的光子学方法，通过不同近似方案模拟振动态光谱。 本研究中模拟与实测得到的振动态光谱压缩包（VibronicSpectra.tar.gz）亦已一并提供。 README.md 文件中包含了有关数据存储方式与访问方法的更多详细信息。