Data for 'Ultrafast Photoexcitation of Semiconducting Photocathode Materials'
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资源简介：
This repository contains the datasets for the article 'Ultrafast Photoexcitation of Semiconducting Photocathode Materials'. The data includes band structures, linear absorption spectra, time-dependent current responses, excitation energy, number of excited electrons, and time-dependent occupation densities. The simulations were performed using the OCTOPUS code implementing density functional theory (DFT) and real-time time-dependent DFT (RT-TDDFT).
创建时间：
2025-03-11
