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Electric contact material of Ag/SnO2 was successfully synthesized by in situ process method.The in-terface structure was characterized by high-resolution transmission electron microscopy(HTEM) and simulated at atomic scale on computer.The mean-square displacements of atoms near the interface were calculated,and the results showed that near the interface both Ag side and SnO2 were mis-matched and this effect decays rapidly far from the interface.By inspecting the calculated density of states(DOS),we found that the electric-conductivity of this composite material was decreased because of the localized 4d and 2p electrons of Ag and O near the Fermi surface,respectively.Electron density changed acutely across the interface,so that there was no extra compound precipitated.A mi-cro-electric field also formed in the whole material due to the interface structure,and this may affect the electron conduction and the related electric-conductivity of the composite.It is found that the interface cohesive energy of Ag(111)/SnO2(200) was-3.50 J/m2,which is higher than the experimental results.
Electric contact material of Ag / SnO2 was successfully synthesized by in situ process method. The in-terface structure was characterized by high-resolution transmission electron microscopy (HTEM) and simulated at atomic scale on computer. The mean-square displacements of atoms near the interface were calculated, and the results showed that near the interface both Ag side and SnO2 were mis-matched and this effect decays rapidly far from the interface. By inspecting the calculated density of states (DOS), we found that the electric-conductivity of this composite material was decreased because of localized 4d and 2p electrons of Ag and O near the Fermi surface, respectively. Electron density changed acutely across the interface, so that there was no extra compound precipitated. A mi-cro-electric field also formed in the whole material due to the interface structure, and this may affect the electron conduction and the related electric-conductivity of the composite. It is found that the interface coh esive energy of Ag (111) / SnO2 (200) was-3.50 J / m2, which is higher than the experimental results.