<?xml version="1.0" encoding="ISO-8859-1"?><article xmlns:mml="http://www.w3.org/1998/Math/MathML" xmlns:xlink="http://www.w3.org/1999/xlink" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance">
<front>
<journal-meta>
<journal-id>0035-001X</journal-id>
<journal-title><![CDATA[Revista mexicana de física]]></journal-title>
<abbrev-journal-title><![CDATA[Rev. mex. fis.]]></abbrev-journal-title>
<issn>0035-001X</issn>
<publisher>
<publisher-name><![CDATA[Sociedad Mexicana de Física]]></publisher-name>
</publisher>
</journal-meta>
<article-meta>
<article-id>S0035-001X2024000600010</article-id>
<article-id pub-id-type="doi">10.31349/revmexfis.70.061002</article-id>
<title-group>
<article-title xml:lang="en"><![CDATA[First principles calculations of physical properties of the CeCu2Si2 material]]></article-title>
</title-group>
<contrib-group>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Jabar]]></surname>
<given-names><![CDATA[A.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
<xref ref-type="aff" rid="Aaf"/>
</contrib>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Idrissi]]></surname>
<given-names><![CDATA[S.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Tahiri]]></surname>
<given-names><![CDATA[N.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Bahmad]]></surname>
<given-names><![CDATA[L.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
</contrib-group>
<aff id="Af1">
<institution><![CDATA[,Hassan II University of Casablanca Faculty of Sciences Aïn Chock LPMAT]]></institution>
<addr-line><![CDATA[Casablanca ]]></addr-line>
<country>Morocco</country>
</aff>
<aff id="Af2">
<institution><![CDATA[,Mohammed V University in Rabat Science Faculty LPHE-MS]]></institution>
<addr-line><![CDATA[ ]]></addr-line>
<country>Morocco</country>
</aff>
<aff id="Af3">
<institution><![CDATA[,Mohammed V University Faculty of Sciences Laboratory of Condensed Matter and Interdisciplinary Sciences (LaMCScI)]]></institution>
<addr-line><![CDATA[Rabat ]]></addr-line>
<country>Morocco</country>
</aff>
<pub-date pub-type="pub">
<day>00</day>
<month>12</month>
<year>2024</year>
</pub-date>
<pub-date pub-type="epub">
<day>00</day>
<month>12</month>
<year>2024</year>
</pub-date>
<volume>70</volume>
<numero>6</numero>
<fpage>0</fpage>
<lpage>0</lpage>
<copyright-statement/>
<copyright-year/>
<self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_arttext&amp;pid=S0035-001X2024000600010&amp;lng=en&amp;nrm=iso"></self-uri><self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_abstract&amp;pid=S0035-001X2024000600010&amp;lng=en&amp;nrm=iso"></self-uri><self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_pdf&amp;pid=S0035-001X2024000600010&amp;lng=en&amp;nrm=iso"></self-uri><abstract abstract-type="short" xml:lang="en"><p><![CDATA[Abstract Using local density approximation functional computations, LSDA (local spin density approximation) and mBJ (modified Becke-Johnson) for exchange-correlation interactions, we examined the combination CeCu2Si2., concentrating on its many physical properties. This work used the WC-GGA method to compute the elastic characteristics of CeCu2Si2. material, and the results indicate that unstrained CeCu2Si2. is more brittle. The density of states exhibits the metallic character of the chemical, in agreement with the inference made from the band structure. We also assessed several optical characteristics, such as real and imaginary optical conductivity, electronic energy loss, absorption coefficient, refractive index, and extinction coefficient. We also looked at the electronic components of thermal conductivity, electrical conductivity, Seebeck coefficient, and electronic conductivity. The compound&#8217;s Seebeck coefficient values are negative, indicating p-type behavior. A thorough analysis of the data is presented, along with important details regarding the CeCu2Si2. compound&#8217;s characteristics.]]></p></abstract>
<kwd-group>
<kwd lng="en"><![CDATA[CeCu2Si2]]></kwd>
<kwd lng="en"><![CDATA[DFT]]></kwd>
<kwd lng="en"><![CDATA[optical properties]]></kwd>
<kwd lng="en"><![CDATA[thermoelectric properties]]></kwd>
<kwd lng="en"><![CDATA[thermodynamic properties]]></kwd>
</kwd-group>
</article-meta>
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