The generalization from empirically determined screened pseudopotentials to self-
consistently screened ab initio pseudopotentials had led to widespread use of the method in …

In this review, we examine the contributions of surface science research to the
understanding of metal-semiconductor interfaces. In particular, we survey conventional …

From its early beginning before the war, the field of semiconductors has developped as a
classical example where the standard approximations of'band theory'can be safely used to …

Theory of Substitutional Deep Traps in Covalent Semiconductors Page 1 VOLUME 44,
NUMBER 12 PHYSICAL REVIEW LETTERS 24 MARcH 1980 Finally, it is interesting to note …

We present (a) a general formulation of the electron-hole interaction which takes into
account both screened electron-hole attraction and its exchange counterpart, giving rise to …

A first-principles embedding theory that combines the salient features of density functional
theory (DFT) and traditional quantum chemical methods is presented. The method involves …

A surface potential is derived which can be added to the Schrodinger equation for a limited
region of space, I, to embed it into a substrate. This potential, which is energy-dependent …

We present a quantitative theory of electron states associated with strongly lattice-coupled
localized defects. Using the total energy functional, we derive optical transition energies …

We have developed a method for calculating self-consistently the electronic structure around
an impurity atom, or an impurity cluster, in a crystalline host. Our method is a Green-function …

Self-interstitials in Si are known to migrate athermally at very low temperatures (− 4 K). In
contrast, at hightemperatures (1100–1600 K), self-diffusion has an activation energy of− 5 …