Los puntos clave no están disponibles para este artículo en este momento.
The role that nonlocal short-range correlation plays at metal surfaces is investigated by analyzing the correlation surface-energy into contributions from dynamical density fluctuations of various two-dimensional wave vectors. Although short-range correlation is known to yield considerable correction to the ground-state energy of both uniform and nonuniform systems, short-range correlation effects on intermediate and short-wavelength contributions to the surface formation energy are found to compensate one another. As a result, our calculated surface energies, which are based on a nonlocal exchange-correlation kernel that provides accurate total energies of a uniform electron gas, are found to be very close to those obtained in the random-phase approximation, and support the conclusion that the error introduced by the local-density approximation is small.
Building similarity graph...
Analyzing shared references across papers
Loading...
J. M. Pitarke
CIC nanoGUNE
John P. Perdew
Tulane University
Physical review. B, Condensed matter
Tulane University
University of the Basque Country
Donostia International Physics Center
Building similarity graph...
Analyzing shared references across papers
Loading...
Pitarke et al. (Mon,) studied this question.
synapsesocial.com/papers/6a0fb7cd92676d5461fd010a — DOI: https://doi.org/10.1103/physrevb.67.045101