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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出版: Animo Repository 2009
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在線閱讀:https://animorepository.dlsu.edu.ph/faculty_research/8498
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機構: De La Salle University

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