Published November 1, 2021
| Version v1
Dataset
Open
DFT Calculation Data for "Stabilized tilted-octahedra halide perovskites inhibit local formation of performance-limiting phases"
Creators
- 1. Yonsei University
- 2. Yonsei University and Imperial College London
Description
Initial and optimized structures that are used for DFT simulations associated with Fig 2A-G in Science 374, 1598 (2021) (DOI: 10.1126/science.abl4890)
Files
initial_structures.zip
Files
(33.1 kB)
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Additional details
Related works
- Is supplement to
- Journal article: 10.1126/science.abl4890 (DOI)