Comment on "Pseudopotentials that work: From H to Pu"

Author(s):
Denteneer, P.J.H. (0000-0001-5351-2390); Haeringen, W. van; Brosens, F.; Devreese, J.T.; Nielsen, O.H.; Camp, P.E. van; Doren, V.E. van
Published
1988
Publication type
Article / Letter to editor

Abstract

In this Comment we report on small differences found in the ion-core pseudopotentials of Si between our results and the values tabulated earlier by Bachelet, Hamann, and Schlüter. It is shown that the rounding of the parameters in their tables leads to inaccuracies. For convenience to future users of the Bachelet-Hamann-Schlüter potentials a correct set of reference tables is given.

Comment behorende bij 10.1103/PhysRevB.26.4199

Date issued
1988-03-15
Language
English
Is part of
Physical Review B (1988), Vol. 37, no. 9, p. 4795-4797
hdl
1887/81473
doi
10.1103/PhysRevB.37.4795