Shaoning Yao, Wei-Tsu Tseng, et al.
ADMETA 2011
In addition to presenting an expression for the pressure which is valid for all treatments of exchange and correlation, we derive a new relation for the kinetic energy of the cores which, in the muffin-tin approximation, leads to an algebraic cancellation of various core contributions to the pressure. Thus, numerical difficulties associated with total-energy and pressure calculations are greatly reduced. © 1974 The American Physical Society.
Shaoning Yao, Wei-Tsu Tseng, et al.
ADMETA 2011
Frank Stem
C R C Critical Reviews in Solid State Sciences
R. Ghez, J.S. Lew
Journal of Crystal Growth
H.D. Dulman, R.H. Pantell, et al.
Physical Review B