van der Waals interaction energies for ferric ion sensors using prismatic and cylindrical pore approximations for a MOF pore
Using the Lennard–Jones potential, we determine analytical expressions for van der Waals interaction energies between a point and a rectangular prism-shaped pore, writing them in terms of standard elementary functions. The parameter values for a new ferric ion sensor are used to compare these calcul...
| Hlavní autoři: | , , |
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| Médium: | Článek |
| Jazyk: | English |
| Vydáno: |
The Royal Society
2023-05-01
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| Edice: | Royal Society Open Science |
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| On-line přístup: | https://royalsocietypublishing.org/doi/10.1098/rsos.230232 |