Magnetic ordering in manganese pyrites

Kalkeren, G. van; Block, R.; Jansen, L.

doi:10.1016/0378-4363(76)90020-6

Cited by 4 publications

(1 citation statement)

References 29 publications

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“…Magnetic structure 1,2 and ordering, 3,4 antiferromagnetic phase transition [5][6][7] and spin correlations 8 of the manganese disulphide have drawn particular attention in stating precisely its magnetic properties. These studies ͑in particular by neutron diffraction͒ show that the pyrite-type phase of MnS 2 (pMnS 2 ) has an antiferromagnetic ordering of the third kind (AF 3 ) below 48 K involving a doubling of the chemical cell in the direction where the moments alternate.…”

Section: Introductionmentioning

confidence: 99%

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

1998

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The linear combination of atomic orbitals as implemented in the CRYSTAL95 code has been used to obtain the electronic structure of the pyrite-type manganese disulphide in the ferromagnetic state. Calculations made at the unrestricted Hartree-Fock ͑UHF͒ and local density approximation levels show that this compound has a larger ionic character within the HF approach. The band structures obtained with both methods of calculation are significantly different. In particular, the valence band is mainly occupied by the p orbitals of sulfur in the UHF approach and the compound is described as an insulator, whereas, at the LDA level, the Mn d orbitals also lie in this band and the compound then has a conductor character. ͓S0163-1829͑98͒02227-9͔

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Section: Introductionmentioning

confidence: 99%

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

1998

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Spin correlations in MnS2

Chattopadhyay

Brückel

Burlet

1992

Physica B: Condensed Matter

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Measurement and calculation of the superexchange interaction through the two-halide bridge in the eclipsed layered compounds[NH3(C
Snively
¹
,
Tuthill
²
,
Drumheller
³

1981
Phys. Rev. B
48
0
13
0
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Measurement and caiculation of the superexchange interaction through the two-halide bridge in the eclipsed layered compounds (NH3(CHq) Magnetic susceptibility measurements on the eclipsed layered structure series of [NH3(CH2) "NH3)CuX (n =2, 3, 4, and 5 for X =C14 and n =2 for X =C12Br2) indicate that the interplanar superexchange interaction along the linear Cu-Cl-Cl-Cu path has a significantly stronger Cu-Cu distance dependence than that for the typical M-X-M (M =Cu, Mn, Ni, Co; X =F, Cl) path, and a stronger power-law metal-metal distance dependence than previously expected for the two-halide bridge case. Furthermore, the evidence indicates a 10th-power dependence on the halide-halide separation, which appears to be the critical parameter for determining the strength of the two-halide superexchange. Previously unpublished data on the partially bromated compound is included. The results of a Rayleigh-Schrodinger perturbation calculation of the two-halide superexchange strength are presented and the calculated results are compared with experimental values.

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Magnetic ordering in manganese pyrites

Cited by 4 publications

References 29 publications

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

Spin correlations in MnS2

Measurement and calculation of the superexchange interaction through the two-halide bridge in the eclipsed layered compounds[NH3(C
Snively
¹
,
Tuthill
²
,
Drumheller
³

1981
Phys. Rev. B
48
0
13
0
View full text Add to dashboard Cite

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Magnetic ordering in manganese pyrites

Cited by 4 publications

References 29 publications

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

Electronic structure of pyrite-type manganese disulphide(pMnS2): Anab initiostudy

Spin correlations in MnS2

Measurement and calculation of the superexchange interaction through the two-halide bridge in the eclipsed layered compounds[NH3(CSnively1, Tuthill2, Drumheller3 1981Phys. Rev. B480130View full textAdd to dashboardCite

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Measurement and calculation of the superexchange interaction through the two-halide bridge in the eclipsed layered compounds[NH3(C
Snively
¹
,
Tuthill
²
,
Drumheller
³

1981
Phys. Rev. B
48
0
13
0
View full text Add to dashboard Cite