First-principles study on field evaporation of surface atoms from W(011) and Mo(011) surfaces

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چکیده

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First-principles study on field evaporation of surface atoms from W(011) and Mo(011) surfaces

The simulations of field-evaporation processes for surface atoms on W(011) and Mo(011) surfaces are implemented using first-principles calculations based on the real-space finite-difference method. The threshold values of the external electric field for evaporation of the surface atoms, which are ∼ 6 V/Å for tungsten and ∼ 5 V/Å for molybdenum, are in agreement with the experimental results. Wh...

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ژورنال

عنوان ژورنال: Surface Science

سال: 2005

ISSN: 0039-6028

DOI: 10.1016/j.susc.2004.12.024