Density Fluctuations, Solvation Thermodynamics and Coexistence Curves in Grand Canonical Molecular Dynamics Simulations
Fuente:
arXiv
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| Main Authors: | Sevilla, Mauricio, Baptista, Luis A., Kremer, Kurt, Cortes-Huerto, Robinson |
|---|---|
| Format: | Preprint |
| Published: |
2024
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| Subjects: | |
| Online Access: | |
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