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D. Hackenbracht and J. Kübler,
Cohesive and Superconducting Properties of La-In Compounds from
Electronic Structure Calculations,
Z. Physik B 35, 27 (1979).
J. Sticht and J. Kübler,
Electronic Structure of Ferromagnetic Gd,
Solid State Commun. 53, 529-532 (1985).
J. Sticht and J. Kübler,
Spin and Orbital Moments in UPt3,
Solid State Commun. 54, 89 (1985).
R. A. de Groot, D. D. Koelling and M. Weger,
UAl2: Fine structure of the f bands,
Phys. Rev. B 32, 2659-2662 (1985).
J. Sticht, N. d'Ambrumenil, J. Kübler,
Quasiparticle Band Structure of CeCu2Si2 and
CeAl3,
Z. Phys. B 65, 149 (1986).
W. Borgiel, G. Borstel and W. Nolting,
Temperature dependence of the electronic quasiparticle structure of
ferromagnetic Gd,
Solid State Commun. 60, 313-317 (1986).
J. Sticht, N. d'Ambrumenil and J. Kübler,
Bandstructure of Heavy Fermions in CeCu2Si2
and CeAl3,
J. Magn. Magn. Mat. 63 & 64, 254 (1987).
W. Nolting, G. Borstel and W. Borgiel,
Dynamical corrections to density-functional theory for quasiparticles
in ferromagnetic 4f systems. I. T=0 results for EuO,
Phys. Rev. B 35, 7015-7024 (1987).
G. Borstel, W. Borgiel and W. Nolting,
Quasiparticle band structure of ferromagnetic EuS,
Phys. Rev. B 36, 5301-5305 (1987).
C. Quitmann, B. Andraka, J.S. Kim, B. Treadway, G. Frauenberger,
G.R. Stewart and J. Sticht,
Understanding the Formation of Heavy Fermion Groundstate in
UPt4Au,
J. Magn. Magn. Mat. 76 & 77, 91 (1988).
J. Sticht, M. Schlott, J. Kübler and B. Elschner,
Comparison of Band Structure Calculation and ESR Measurement of
CePd3,
J. Magn. Magn. Mat. 76 & 77, 469 (1988).
W. Nolting, W. Borgiel and G. Borstel,
Coulomb correlation effects in the quasiparticle band structure of
ferromagnetic rare-earth insulators,
Phys. Rev. B 37, 7663-7672 (1988).
K. Schwarz,
Symmetry breaking in
La2-xBaxCuO4,
Solid State Commun. 64, 421-424 (1989).
R. Coehoorn, K. H. J. Buschow, M. W. Dirken, and R. C. Thiel,
Valence-electron contributions to the electric-field gradient in hcp
metals and at Gd nuclei in intermetallic compounds with the
ThCr2Si2 structure,
Phys. Rev. B 42, 4645-4655 (1990).
R. Coehoorn,
First principles band structure calculations for rare earth-transition
metal compounds: magnetization, hyperfine parameters and
magnetocrystalline anisotropy,
J. Magn. Magn. Mat. 99, 55-70 (1991).
C. Ambrosch-Draxl and K. Schwarz,
Local-spin-density calculations of antiferromagnetic
YBa2Cu3O6 and
La2CuO4,
Solid State Commun. 77, 45-48 (1991).
P. M. Oppeneer, J. Sticht and F. Herman,
Theory of the magneto-optical properties of transition metals and
rare-earth compounds,
J. Magn. Soc. Jpn. 15 (S1), 73-78 (1991).
J. Sticht and J. Kübler,
Calculated electronic and magnetic structure of
UNi2Al3 and
UPd2Al3,
Z. Physik B 87, 299-304 (1992).
C. Hellwig, K. Girgis, R. Coehoorn, K. H. J. Buschow, P. Fischer and
J. Schefer,
Crystal and magnetic structure of the permanent magnetic material
Ho2Fe14,
J. Alloys Comp. 184, 161-173 (1992).
S. Darracq, S. Matar and G. Demazeau,
Correlations between the structural distorsion of
LaCuO3 lattice and the resulting physical
properties,
Solid State Commun. 85, 961 (1993).
L. M. Sandratskii, J. Kübler,
Local magnetic moments of conduction electrons in Gadolinium,
Europhys. Lett. 23, 661-666 (1993).
M. Uhl, L. M. Sandratskii and J. Kübler,
Itinerant-electron antiferromagnetism in ThMn2,
Int. J. Mod. Phys. B 7, 1027-1030 (1993).
J. Kübler, M. Uhl and L. M. Sandratskii,
Itinerant electron antiferromagnetism in ThMn2,
Physica B 186, 863 (1993).
W. Borgiel and J. Deniszczyk,
Scalar relativistic spin polarized electronic structure of ferromagnetic
fcc GdAl2,
Acta Phys. Polon. A 84, 1071-1083 (1993).
M. Abbate, R. Potze, G. A. Sawatzky, and A. Fujimori,
Band-structure and cluster-model calculations of LaCoO3 in
the low-spin phase,
Phys. Rev. B 49, 7210-7218 (1994).
G. Demazeau, B. Siberchicot, S. Matar, C. Gayet and A. Largeteau,
A new ferromagnetic oxide La2MnIrO5: synthesis,
characterization and calculation of its electronic structure,
J. Appl. Phys. 75, 8 (1994).
S. Matar, B. Chevalier and J. Etourneau,
Band theoretical investigation within the local density approximation
of the ferromagnetic silicides: UFe10Si2,
UCo10Si2 and YFe10Si2,
J. Magn. Magn. Mat. 137, 293-304 (1994).
L. M. Sandratskii and J. Kübler,
Inferred physical properties of
UTO2SiO2, (T = Rn, Rh, Pd) from
spin-density functional calculations,
Solid State Commun. 91, 183-186 (1994).
L. M. Sandratskii and J. Kübler,
Magnetism of
UT2Si2
, (T = C, Mn, Fe,Co, Ni, Cu, Rn, Rh, Pd, Os) from spin-density
functional calculations,
Phys. Rev. B 50, 9258-9264 (1994).
L. M. Sandratskii, J. Kübler, P. Zahn and I. Mertig,
Electronic structure, magnetic and Fermi-surface properties of
UPd2Al3,
Phys. Rev. B 50, 15834-15843 (1994).
V. Eyert, K.-H. Höck and P. S. Riseborough,
The electronic structure of La2BaCuO5:
A magnetic insulator,
Europhys. Lett. 31, 385-391 (1995).
S. Matar, B. Chevalier, F. Mirambet and J. Etourneau,
Orbital magnetism in URhSn,
J. Magn. Magn. Mat. 140-144, 1389-1390 (1995).
L. M. Sandratskii and J. Kübler,
Spin-density functional theory of the magnetism of
UT2Si2 compounds ,
J. Magn. Magn. Mat. 140-144, 1397 (1995).
S. Matar,
The calculated electronic and magnetic properties of
U2T2Sn (T = Fe, Co, Ni),
J. Magn. Magn. Mat. 151, 263 (1995).
T. Kraft, P. M. Oppeneer, V. N. Antonov, and H. Eschrig,
Relativistic calculations of the magneto-optical Kerr spectra in
(001) and (111) US, USe, and UTe,
Phys. Rev. B 52, 3561-3570 (1995).
L. M. Sandratskii and J. Kübler,
Magnetic structures of uranium compounds: Effects of relativity and
symmetry,
Phys. Rev. Lett. 75, 946-949 (1995).
K. Knöpfle, A. Mavromaras, L. M. Sandratskii and J. Kübler,
The Fermi surface of UPd2Al3,
J. Phys.: Cond. Matt. 8, 901-909 (1996).
L. M. Sandratskii and J. Kübler,
Noncollinear Magnetic Order and Electronic Properties of
U2Pd2Sn and
U3P4,
Physica B 217, 167-180 (1996).
K. C. Mishra, I. Osterloh, H. Anton, B. Hannebauer, P.C. Schmidt and
K. H. Johnson,
First principles investigation of host excitation of LaPO4,
La2O3 and AlPO4,
J. Lumin. 72-74, 144-145, (1997).
K. C. Mishra, I. Osterloh, H. Anton, B. Hannebauer, P.C. Schmidt and
K. H. Johnson,
Electronic structures and host excitation of LaPO4,
La2O3 and AlPO4,
J. Mater. Res. 12, 2183-2190, (1997).
S. F. Matar, V. Eyert, B. Chevalier and J. Etourneau,
Local density functional calculations of the electronic structures of
the intermetallic systems U2Fe2Sn and
UFe2Ge2,
Int. J. Quantum Chem. 61, 705-709 (1997).
S. F. Matar and V. Eyert,
Chemical bonding and magnetism in the equiatomic intermetallic system
UCoSn from first principles,
J. Magn. Magn. Mat. 166, 321-328 (1997).
J. Köhler, L. M. Sandratskii and J. Kübler,
Magneto-optical properties of U-5f electrons in
U3P4,
Phys. Rev. B 55, R10153 (1997).
L. M. Sandratskii and J. Kübler,
Electronic properties and magnetic structure of
U3X4 (X = P, As, Sb),
Phys. Rev. B 55, 11395 (1997).
S. F. Matar, V. Eyert, A. Mavromaras, S. Najm, B. Chevalier
and J. Etourneau,
Chemical bonding and magnetism in the ternary germanides
UT2Ge2 (T = 3d transition metal) from local
spin density functional calculations,
J. Magn. Magn. Mat. 174, 219-235 (1997).
L. M. Sandratskii and J. Kübler,
Electronic and magnetic properties of UPdSn: itinerant 5f electron
approach,
J. Phys.: Cond. Matt. 9, 4897-4908 (1997).
K. Knöpfle, L. M. Sandratskii and J. Kübler,
Asymmetry properties of intra-atomic spin and angular momentum densities:
application to U3Sb4,
J. Phys.: Cond. Matt. 9, 7095-7104 (1997).
S. F. Matar, V. Eyert, S. Najm, B. Chevalier and J. Etourneau,
Chemical bonding and magnetism in the ternary germanides
HT-UCo2Ge2, UGe3 and
U3Co4Ge7 from local spin density
functional calculations,
J. Mat. Chem. 8, 1303-1309 (1998).
A. Mavromaras, L. M. Sandratskii and J. Kübler,
Magnetism of UT2Si2
compounds: effect of the orbital polarization correction,
Solid State Commun. 106, 115-119 (1998).
M. Uhl, S. F. Matar and B. Siberchicot,
Calculated magnetic and electronic properties of the double
perovskites
La2TIrO6
(T = Mn, Fe, Co) ,
J. Magn. Magn. Mat. 187, 201-209 (1998).
K. Prokes, M. Divis, P. Mohn, K. Schwarz, V. Sechovsky, P. Svoboda,
M. Richter, K.H.J. Buschow, E. Brück and F.R. de Boer,
Reduced magnetic moments in UNiSi,
J. Alloys Comp. 269, 43-49 (1998).
S. Matar and J. Etourneau,
Local spin density functional investigations of the ternary systems
UT2Ge2 (T = Mn, Fe),
J. Alloys Comp. 275-277, 468 (1998).
J. Köhler, L. M. Sandratskii and J. Kübler,
Optical Properties of U3P4,
Physica B 253, 222-237 (1998).
L. M. Sandratskii and J. Kübler,
Conduction Electron States in Gadolinium at Finite Temperatures,
in: Magnetism and Electronic Correlations in Local-Moment Systems:
Rare-Earth Elements and Compounds,
edited by M. Donath, P. A. Dowben and W. Nolting (World Scientific, Singapore,
1998), pp. 271-291.
S. F. Matar, F. Varagniat, B. Chevalier, and J. Etourneau,
Chemical bonding and band magnetism in U2T2Sn
(T=Fe,Co,Ni,Pd) stannides from first principles,
Annales de Chimie 23, 33-36 (1998).
S. Rex, V. Eyert and W. Nolting,
Temperature-dependent quasiparticle bandstructure of ferromagnetic
gadolinium,
J. Magn. Magn. Mat. 192, 529-542 (1999).
S. F. Matar and A. Mavromaras,
Band magnetism in A2T2Sn (A=Ce,U; T=Ni,Pd)
from local spin densitiy functional calculations,
J. Solid State Chem. 149, 449-454 (2000).
M. Divis, P. Mohn, K. Schwarz, P. Blaha and P. Novak,
Electronic structure and magnetism of itinerant 5f ferromagnets
URhSi and URhGe,
Plenum Publ. Corp., in press.
S. F. Matar,
Local spin density functional investigations of the chemical bonding
and of the magnetism in some uranium ternary intermetallic systems:
how physics and chemistry can meet in the solid state,
Int. J. Quant. Chem. 77, 911-926 (2000),
Special Issue: Electronic Structure of Materials,
edited by M. Defranceschi.
S. F. Matar and J. Etourneau,
The electronic structure of uranium borides from local spin density
functional calculations,
Int. J. Inorg. Mat. 2, 43-51 (2000).
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