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Electronic structure of silver (100)
44
Citations
19
References
1980
Year
EngineeringWork FunctionComputational ChemistryMetallic NanomaterialsElectronic StructureStatistical Field TheoryQuantum MaterialsExotic StateMaterials SciencePhysicsSelf-consistent Local-orbital MethodNanotechnologyAtomic PhysicsNon-perturbative QcdQuantum ChemistrySolid-state PhysicNatural SciencesSurface ScienceApplied PhysicsCondensed Matter Physics
The electronic structure of silver (100) is calculated using the self-consistent local-orbital method. The work function is found to be 4.2 eV. A large density of surface states is obtained, comparable to that found for Ni(100), and larger than we found for Pd(100). ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}}_{\ensuremath{\parallel}}$-selected densities of states (DOS) are given for ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}}_{\ensuremath{\parallel}}$ along the $\overline{\ensuremath{\Gamma}}\ensuremath{-}\overline{X}[110]$ and $\overline{\ensuremath{\Gamma}}\ensuremath{-}\overline{M}[100]$ directions. A strong variation with ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}}_{\ensuremath{\parallel}}$ is found. Results for states which are even with respect to mirror-plane reflection are very different from those for states which are odd. Peaks in ${\stackrel{\ensuremath{\rightarrow}}{\mathrm{k}}}_{\ensuremath{\parallel}}$-selected DOS which are due to surface-state bands are identified.
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