Bulk and surface characterization of InO(001) single crystals
DR Hagleitner, M Menhart, P Jacobson… - Physical Review B …, 2012 - APS
A comprehensive bulk and surface investigation of high-quality In 2 O 3 (001) single crystals
is reported. The transparent-yellow, cube-shaped single crystals were grown using the flux …
is reported. The transparent-yellow, cube-shaped single crystals were grown using the flux …
Site localization of Cd impurities in sapphire
By combining first-principles electronic structure calculations and existing time-differential γ-
γ perturbed-angular-correlation experiments we studied the site localization, the local …
γ perturbed-angular-correlation experiments we studied the site localization, the local …
LSDA and LSDA study of pure and Cd-doped cubic lanthanide sesquioxides
The electronic, structural, and hyperfine properties of pure and Cd-doped lanthanide (Ln)
sesquioxides with the cubic bixbyite structure (Ln 2 O 3, Ln ranging from La to Lu) have …
sesquioxides with the cubic bixbyite structure (Ln 2 O 3, Ln ranging from La to Lu) have …
First-principles and time-differential perturbed-angular-correlation spectroscopy study of structural and electronic properties of Ta-doped semiconductor
The, time-differential γ-γ perturbed-angular-correlation (TDPAC) technique using ion-
implanted H 181 f (→ T 181 a) tracers was applied to study the hyperfine interactions of T …
implanted H 181 f (→ T 181 a) tracers was applied to study the hyperfine interactions of T …
Electronic and structural properties, and hyperfine interactions at Sc sites in the semiconductor : TDPAC and ab initio study
The time-differential γ-γ perturbed-angular-correlation (TDPAC) technique using T 44 i→ S
44 c tracers was applied to study the nuclear quadrupole interaction of the first excited I= 1 …
44 c tracers was applied to study the nuclear quadrupole interaction of the first excited I= 1 …
Ab initio study of structural and electronic properties and hyperfine interactions at the Ta nucleus in Ta-doped monoclinic
RE Alonso, LA Errico, EL Peltzer y Blancá… - Physical Review B …, 2008 - APS
The electronic and structural properties of pure and Ta-doped monoclinic HfO 2 have been
examined by means of ab initio density-functional calculations. The full-potential linear …
examined by means of ab initio density-functional calculations. The full-potential linear …
Cd in SnO: probing structural effects on the electronic structure of doped oxide semiconductors through the electric field gradient at the Cd nucleus
We perform an ab initio study of the electric field gradient (EFG) at the nucleus of Cd
impurities at substitutional Sn sites in crystalline SnO. The full-potential linearized …
impurities at substitutional Sn sites in crystalline SnO. The full-potential linearized …
Experimental and First-Principles Theoretical Study of Structural and Electronic Properties in Tantalum-Doped In2O3 Semiconductor: Finding a Definitive Hyperfine …
In this work we present an experimental and theoretical study from first-principles of the
structural, electronic, and hyperfine properties of Ta-doped In2O3 semiconductor. The ab …
structural, electronic, and hyperfine properties of Ta-doped In2O3 semiconductor. The ab …
Ab initio based description of the unusual increase of the electric field gradient with temperature at Ti sites in rutile
AV Nikolaev, NM Chtchelkatchev, AV Bibikov… - Physical Review B, 2020 - APS
Combining a precise ab initio electron band structure calculation of the TiO 2 rutile structure
with the temperature evolution of the Ti mean-square displacements, we reproduce a …
with the temperature evolution of the Ti mean-square displacements, we reproduce a …
PAC study of dynamic hyperfine interactions at 111In-doped Sc2O3 semiconductor and comparison with ab initio calculations
Abstract Time-Differential \upgamma-\upgamma Perturbed-Angular-Correlation (PAC)
measurements were performed in 111 In-difussed Sc 2 O 3 polycrystals in order to …
measurements were performed in 111 In-difussed Sc 2 O 3 polycrystals in order to …