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Structural and magnetization density studies of La sub 2 NiO sub 4

Journal Article · · Physical Review (Section) B: Condensed Matter; (USA)
 [1];  [2]; ;  [3]
  1. Commission of European Communities, Joint Research Centre, Postfach 2340, D-7500 Karlsruhe, Federal Republic of Germany (DE)
  2. Institut Laue-Langevin 156X, 38042 Grenoble CEDEX, France
  3. Department of Physics and Department of Chemistry, Purdue University, West Lafayette, Indiana 47907-3699

Neutron diffraction experiments have been performed on single crystals of La{sub 2}NiO{sub 4}. Above 70 K the structure is orthorhombic {ital Bmab}. At 70 K a first-order transition occurs to a crystal structure that we believe to be tetragonal {ital P}4{sub 2}/ncm. With our resolution we see no splitting of the diffraction peaks that would indicate the lower-symmetry orthorhombic {ital Pccn}. A crystallographic refinement of 307 independent reflections from two different crystals gives an {ital R} factor of 6% for the {ital P}4{sub 2}/ncm phase. The refinement also shows that our crystals are stoichiometric with an oxygen composition of 4.02{plus minus}0.03. The crystals are antiferromagnetic with a magnetic structure in which the propagation and spin directions are parallel to (100), in agreement with other studies. The antiferromagnetic ordered moment at {ital T}=10 K is (1.62{plus minus}0.05){mu}{sub {ital B}} per Ni atom. According to susceptibility measurements {ital T}{sub {ital N}}{congruent}650 K on stoichiometric La{sub 2}NiO{sub 4}, but we have not checked this in our neutron experiment. No change in the antiferromagnetic structure occurs at the 70-K transition, but we cannot exclude the formation of a 2{bold k} magnetic structure at this temperature that would give rise to the same diffraction pattern in the tetragonal phase. In the second part of our experiment the induced magnetic form factor ({ital H}=4.6 T, applied parallel to the (010) axis at 5 K) has been measured with polarized neutrons. Our object in this experiment was to search for covalency effects, in particular evidence of interaction between the Ni {ital d}{sub {ital x}{sup 2}{minus}{ital y}{sup 2}} orbital and the {ital p}{sub {ital x}}, {ital p}{sub {ital y}} orbitals of the oxygens in the Ni-O plane.

OSTI ID:
5524902
Journal Information:
Physical Review (Section) B: Condensed Matter; (USA), Journal Name: Physical Review (Section) B: Condensed Matter; (USA) Vol. 40:7; ISSN 0163-1829; ISSN PRBMD
Country of Publication:
United States
Language:
English