Crystal Morphology Prediction of LTNR in Different Solvents by Molecular Dynamics Simulation
Molecular dynamics simulations were conducted using the attachment energy (AE) model to investigate the growth morphology of lead 2,4,6-trinitrororesorcinate (LTNR, lead styphnate) under vacuum and different solvents. The adsorption energy of LTNR on (001), (110), (011), (020), (111), (200), and (20...
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| Main Authors: | , , , , |
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| Format: | Artigo |
| Language: | Inglês |
| Published: |
MDPI AG
2025-10-01
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| Series: | Chemistry |
| Subjects: | |
| Online Access: | https://www.mdpi.com/2624-8549/7/5/161 |
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