Zdzislawa Szotek
Zdzislawa Szotek
STFC Daresbury Laboratory
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Understanding the valency of rare earths from first-principles theory
P Strange, A Svane, WM Temmerman, Z Szotek, H Winter
Nature 399 (6738), 756-758, 1999
Electronic structures of normal and inverse spinel ferrites from first principles
Z Szotek, WM Temmerman, D Ködderitzsch, A Svane, L Petit, H Winter
Physical Review B 74 (17), 174431, 2006
Order-N multiple scattering approach to electronic structure calculations
Y Wang, GM Stocks, WA Shelton, DMC Nicholson, Z Szotek, ...
Physical review letters 75 (15), 2867, 1995
Application of the self-interaction correction to transition-metal oxides
Z Szotek, WM Temmerman, H Winter
Physical Review B 47 (7), 4029, 1993
Electronic Structure and Elastic Properties of Strongly Correlated Metal Oxides from First Principles: LSDA + U, SIC‐LSDA and EELS Study of UO2 and NiO
SL Dudarev, GA Botton, SY Savrasov, Z Szotek, WM Temmerman, ...
Physica status solidi (a) 166 (1), 429-443, 1998
Lanthanide contraction and magnetism in the heavy rare earth elements
ID Hughes, M Däne, A Ernst, W Hergert, M Lüders, J Poulter, JB Staunton, ...
Nature 446 (7136), 650-653, 2007
First-principles study of rare-earth oxides
L Petit, A Svane, Z Szotek, WM Temmerman
Physical Review B 72 (20), 205118, 2005
First-principles calculations of PuO2±x
L Petit, A Svane, Z Szotek, WM Temmerman
Science 301 (5632), 498-501, 2003
Half-metallic to insulating behavior of rare-earth nitrides
CM Aerts, P Strange, M Horne, WM Temmerman, Z Szotek, A Svane
Physical Review B 69 (4), 045115, 2004
Self-interaction corrected, local spin density description of the γ→ α transition in Ce
Z Szotek, WM Temmerman, H Winter
Physical review letters 72 (8), 1244, 1994
Electronic structure and ionicity of actinide oxides from first principles
L Petit, A Svane, Z Szotek, WM Temmerman, GM Stocks
Physical Review B 81 (4), 045108, 2010
Self-interaction correction in multiple scattering theory
M Lüders, A Ernst, M Däne, Z Szotek, A Svane, D Ködderitzsch, W Hergert, ...
Physical Review B 71 (20), 205109, 2005
Exchange coupling in transition metal monoxides: Electronic structure calculations
G Fischer, M Däne, A Ernst, P Bruno, M Lüders, Z Szotek, W Temmerman, ...
Physical Review B 80 (1), 014408, 2009
Ab initio angle-resolved photoemission in multiple-scattering formulation
M Lüders, A Ernst, WM Temmerman, Z Szotek, PJ Durham
Journal of Physics: Condensed Matter 13 (38), 8587, 2001
Electronic structure and exchange coupling of Mn impurities in III–V semiconductors
TC Schulthess, WM Temmerman, Z Szotek, WH Butler, G Malcolm Stocks
Nature materials 4 (11), 838-844, 2005
Experimental evidence of the ferrimagnetic ground state of Sr2FeMoO6 probed by X-ray magnetic circular dichroism
M Besse, V Cros, A Barthélémy, H Jaffrès, J Vogel, F Petroff, A Mirone, ...
EPL (Europhysics Letters) 60 (4), 608, 2002
Electronic structure of half-metallic double perovskites
Z Szotek, WM Temmerman, A Svane, L Petit, H Winter
Physical Review B 68 (10), 104411, 2003
Exchange interactions in NiO and at the NiO (100) surface
D Ködderitzsch, W Hergert, WM Temmerman, Z Szotek, A Ernst, H Winter
Physical Review B 66 (6), 064434, 2002
The electronic structure of europium chalcogenides and pnictides
M Horne, P Strange, WM Temmerman, Z Szotek, A Svane, H Winter
Journal of Physics: Condensed Matter 16 (28), 5061, 2004
Structural phase transitions and fundamental band gaps of Mg x Zn 1− x O alloys from first principles
IV Maznichenko, A Ernst, M Bouhassoune, J Henk, M Däne, M Lueders, ...
Physical Review B 80 (14), 144101, 2009
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