Orbital-resolved observation of Singlet Fission

Datasets used for the publication "Orbital-resolved observation of Singlet Fission" . The datasets will be published after the corresponding article has been published in a journal. The datasets are stored in the HDF5 file format and can be easily handled with the python package HDF5. They contain a list of 3D datasets with the axes (kx, ky, E). Each entry of the list corresponds to a different time delay. The time delays are indicated for each dataset and equally spaced for the continuous datasets. The energy axis was shifted in the figures and referenced to the maximum energy of the valence band (EVBM) obtained by fitting Gaussians to the EDCs. Dataset_1short_snapshots is used for Fig. 2a, b (TT) and Fig. 4g (t = -200, 40, 50, 60, 70, 80, 90, 150 [fs]) Dataset_1long_snapshots is used for Fig. 2a, b (TT) and Fig. 4g (t = 500, 1000, 2000, 10000 [fs]) Dataset_2_snapshots is used for Fig. 2b (S, X, VBM), Ext. data Fig. 1a, b, c, Ext. data Fig. 2 (t = -80, -20, -10, 0, 10, 20, 30, 100 [fs]) Dataset_3_continuous is used for Fig. 4a, b, c, d, e, f and Ext. data Fig. 1d, e, Ext. data Fig. 3, Ext. data Fig. 5, Ext. data Fig. 6, Ext. data Fig. 7, Ext. data Fig. 9 (t = -10 to 140 [fs]) Dataset_4_continuous is used for Fig. 4f (-50 to 300 [fs]) Dataset_5_continuous is used for Fig. 4f (t = -100 to 600 [fs]) Dataset_6short_snapshots is used for Ext. data Fig. 4a (t = -300, 0, 20, 50, 100, 200 [fs]) Dataset_6long_snapshots is used for Ext. data Fig. 4a (t = -500, 500, 1000, 10000 [fs]) Dataset_7_continuous is used for Ext. data Fig. 4b, c (t = -60 to 170 [fs])本数据集配套于学术论文《单线态裂分（Singlet Fission）的轨道分辨观测》，该数据集将在配套论文正式发表于学术期刊后对外公开。数据集以HDF5文件格式存储，可通过Python的HDF5库进行便捷处理；数据集包含一组三维数据集，其坐标轴为(kx, ky, E)，列表中的每个条目对应不同的时间延迟，每个数据集均标注了对应的时间延迟值，连续型数据集的时间延迟为等间距分布。所有图表中的能量轴均已完成位移校准，以通过对能量分布曲线（Energy Distribution Curves，简称EDCs）拟合高斯函数得到的价带最大能量（EVBM）作为参考零点。Dataset_1short_snapshots 用于图2a、b（TT）以及图4g（t = -200, 40, 50, 60, 70, 80, 90, 150 [fs]）；Dataset_1long_snapshots 用于图2a、b（TT）以及图4g（t = 500, 1000, 2000, 10000 [fs]）；Dataset_2_snapshots 用于图2b（S, X, VBM）、补充数据图1a、b、c以及补充数据图2（t = -80, -20, -10, 0, 10, 20, 30, 100 [fs]）；Dataset_3_continuous 用于图4a、b、c、d、e、f以及补充数据图1d、e、补充数据图3、补充数据图5、补充数据图6、补充数据图7、补充数据图9（t = -10 至 140 [fs]）；Dataset_4_continuous 用于图4f（-50 至 300 [fs]）；Dataset_5_continuous 用于图4f（t = -100 至 600 [fs]）；Dataset_6short_snapshots 用于补充数据图4a（t = -300, 0, 20, 50, 100, 200 [fs]）；Dataset_6long_snapshots 用于补充数据图4a（t = -500, 500, 1000, 10000 [fs]）；Dataset_7_continuous 用于补充数据图4b、c（t = -60 至 170 [fs]）