2022
DOI: 10.1016/j.molstruc.2022.133698
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Investigation of electronic structure, magnetic stability, spin coupling, and thermodynamic properties of novel antiferromagnets XMn2Y2 (X = Ca, Sr; Y = P, As)

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Cited by 12 publications
(5 citation statements)
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“…Curiously, the XMn 2 Si 2 compounds essentially non-symmetric appearance in their multiple states (X-f, Mn-d, and Si-p) spectra by both channels, which reside in valence and conduction bands, contradicts the stoner argument's. 4,7,12,16 Magnetic properties.-Spin polarized computations using the PBE-GGA and GGA+U potentials are used to examine the magnetic properties of XMn 2 Si 2 (X=Dy, Er) compounds. The Table II provides an overview of the individual (Dy/Er, Mn, and Si) and interstitial magnetic moments, (total for each cell m c ) magnetic moments of the rare-Earth based compounds under consideration.…”
Section: Resultsmentioning
confidence: 99%
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“…Curiously, the XMn 2 Si 2 compounds essentially non-symmetric appearance in their multiple states (X-f, Mn-d, and Si-p) spectra by both channels, which reside in valence and conduction bands, contradicts the stoner argument's. 4,7,12,16 Magnetic properties.-Spin polarized computations using the PBE-GGA and GGA+U potentials are used to examine the magnetic properties of XMn 2 Si 2 (X=Dy, Er) compounds. The Table II provides an overview of the individual (Dy/Er, Mn, and Si) and interstitial magnetic moments, (total for each cell m c ) magnetic moments of the rare-Earth based compounds under consideration.…”
Section: Resultsmentioning
confidence: 99%
“…[1][2][3][4][5] Nowadays, the interest in the direction of the exploration of materials containing intermetallic phases have become more common due to their intriguing characteristics and different wide range applications and featuring new approaches like shape memory alloys, in jewelry and dentistry 2,3 innovative computer read along with their inspirational utilization by way of "colossal-magneto resistive (C-M-R)" or "giant-magneto-resistive consequence". 6,7 Usually, the magnetoresistance is metallic thin films, which are able to vary the resistivity in relation to the external field. [8][9][10][11][12][13][14] The G-MR are diverse applications like spin values, spin filter, are also a key role in the major magnetic field sensor.…”
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confidence: 99%
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“…In line with the preceding discussion, several researchers have tried to physically explore the physical structure and magnetic properties of ThMn 2 X 2 (X = Si, Ge) compounds to some extent, although theoretical evidence is still lacking. Because of their attracting physical properties, some research has already been done on members of the same class of materials [ 21 , 22 , 23 , 24 , 25 , 26 ]. The current study was prompted in part by a knowledge gap in the fundamental structural, electronic, and magnetic properties of ternary intermetallic ThMn 2 Si 2 and ThMn 2 Ge 2 compounds, which were not well known or improved, in comparison with their counterparts.…”
Section: Introductionmentioning
confidence: 99%