A first principles study of Palladium-based full Heusler ferromagnetic Pd2MnSb compound
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216208%3A11140%2F24%3A10473178" target="_blank" >RIV/00216208:11140/24:10473178 - isvavai.cz</a>
Result on the web
<a href="https://verso.is.cuni.cz/pub/verso.fpl?fname=obd_publikace_handle&handle=jRaXcnk72b" target="_blank" >https://verso.is.cuni.cz/pub/verso.fpl?fname=obd_publikace_handle&handle=jRaXcnk72b</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1007/s11082-023-05463-8" target="_blank" >10.1007/s11082-023-05463-8</a>
Alternative languages
Result language
angličtina
Original language name
A first principles study of Palladium-based full Heusler ferromagnetic Pd2MnSb compound
Original language description
Density functional theory (DFT)-based calculations were used to calculate the physical properties of the full Heusler compound Pd2MnSb. The WIEN2K code is used with various approximations, such as generalized Gradient approximation (GGA) and (GGA + U) potentials, to investigate the structural, electronic, and magnetic responses. The unit volume cell is optimized to achieve the ground state energy level. The calculated band structure with both potentials confirms the metallic behavior of the selected compound, Pd2MnSb. The total density of states is also calculated by using these potentials, which confirms their metallic behavior. The calculated partial density of state with GGA and GGA + U potentials confirmed the particular contribution of atoms. We have calculated the magnetic properties with the GGA and GGA + U potentials to find out the total magnetic moment values that are suitable with the available experimental data. The calculated magnetic moments show that Pd2MnSb is a magnetized material. These investigated properties show that Pd2MnSb has metallic magnetized characteristics and is perfectly suitable for the applications of mass storage devices as a ferromagnetic material.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10305 - Fluids and plasma physics (including surface physics)
Result continuities
Project
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Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Others
Publication year
2024
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Optical and Quantum Electronics
ISSN
0306-8919
e-ISSN
1572-817X
Volume of the periodical
56
Issue of the periodical within the volume
2
Country of publishing house
US - UNITED STATES
Number of pages
12
Pages from-to
248
UT code for WoS article
001131800900026
EID of the result in the Scopus database
2-s2.0-85180714881