Virtual screening of n-type organic semiconductors using exhaustive band structure calculations
We performed a virtual screening of high-mobility n-type organic semiconductor materials using the Cambridge Structural Database (CSD) and large-scale band structure calculations. Over 220,000 crystal structures from the CSD were preliminarily screened, narrowing the selection to 461 candidates with...
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| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Taylor & Francis Group
2025-12-01
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| Series: | Science and Technology of Advanced Materials: Methods |
| Subjects: | |
| Online Access: | https://www.tandfonline.com/doi/10.1080/27660400.2024.2442902 |
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