Dataset: Tautomeric Mixture Coordination Enables Efficient Lead-Free Perovskite LEDs
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下载链接：
https://zenodo.org/record/8409189
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资源简介：
Molecular dynamics trajectories showing the adsorption, clustering and tautomerization of Cyanuric acids molecules on 2D TEA2SnI4 and 3D CsSnI3 Perovskites
Typical input file for running these simulations on CP2k
创建时间：
2023-10-05
