Preliminary investigation on dimer-pyrrole adsorption on aluminum, copper, and silicon surfaces (100): A first principle calculation
We calculated ground-state binding energies of dimer-pyrrole (di-Py) on Aluminum (Al), Copper (Cu), and Silicon (Si) surfaces. Adsorption of dimer-pyrrole on these surfaces could provide a way on how to calculate the activation energy for each configuration. These activation energies are vital infor...
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Main Authors: | Villagracia, Al Rey C., Pobre, Romerick F., Manzano, Enrique M., Manzano, Maria Carla F., Quiroga, Reuben V. |
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Animo Repository
2009
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在線閱讀: | https://animorepository.dlsu.edu.ph/faculty_research/8498 |
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