TY  - JOUR
AU  - Errico, L. A.
AU  - Fabricius, G.
AU  - Rentería, M
AU  - Presa Muñoz del Toro, Patricia de la
AU  - Forker, M.
PY  - 2002
DO  - 10.1103/PhysRevLett.89.055503
SN  - 0031-9007
UR  - https://hdl.handle.net/20.500.14352/60212
T2  - Physical review letters
AB  - We present an ab initio study of the relaxations introduced in TiO₂  when a Cd impurity substitutes a Ti atom and an experimental test of this calculation by a perturbed-angular-correlation (PAC) measurement of the orientation of the electric-field...
LA  - eng
PB  - American Physical Society
KW  - Electric-field gradients
KW  - Ab-initio
KW  - Temperature-dependence
KW  - Approximation
KW  - Cd-111
KW  - Oxides
KW  - Sites
TI  - Anisotropic relaxations introduced by Cd impurities in rutile TiO₂: First-principles calculations and experimental support
TY  - journal article
VL  - 89
ER  -