TY  - JOUR
AU  - Galanakis, I.
AU  - Mavropoulos, T. B.
TI  - Zinc-blende compounds of transition elements with N, P, As, Sb, S, Se, and Te as half-metallic systems
JO  - Physical review / B
VL  - 67
IS  - 10
SN  - 0163-1829
CY  - College Park, Md.
PB  - APS
M1  - PreJuSER-29679
SP  - 104417
PY  - 2003
N1  - Record converted from VDB: 12.11.2012
AB  - We report systematic first-principles calculations for ordered zinc-blende compounds of the transition metal elements V, Cr, and Mn with the sp elements N, P, As, Sb, S, Se, and Te, motivated by a recent fabrication of zinc-blende CrAs, CrSb, and MnAs. They show a ferromagnetic half-metallic behavior for a wide range of lattice constants. We discuss the origin and trends of half-metallicity, present the calculated equilibrium lattice constants, and examine the half-metallic behavior of their transition element terminated (001) surfaces.
KW  - J (WoSType)
LB  - PUB:(DE-HGF)16
UR  - <Go to ISI:>//WOS:000182033700056
DO  - DOI:10.1103/PhysRevB.67.104417
UR  - https://juser.fz-juelich.de/record/29679
ER  -