predict adsorption energies

What Factors Affect Adsorption Energies?

Several factors affect adsorption energies, including:
1. Surface Structure: The crystallographic orientation and defects on the surface can significantly influence adsorption energies.
2. Chemical Composition: The type of atoms and their arrangement in the adsorbent material play a crucial role.
3. Adsorbate Properties: The size, shape, and electronic properties of the adsorbate can affect how it interacts with the surface.
4. Environmental Conditions: Temperature, pressure, and the presence of other molecules can alter adsorption energies.

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