<?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>S0035-001X2016000600526</article-id>
<title-group>
<article-title xml:lang="en"><![CDATA[Calculation of the lattice energy and the energy gap of the magnetic semiconductor MnGa2 Se4 using Hartree-Fock and density functional theory methods]]></article-title>
</title-group>
<contrib-group>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Romero]]></surname>
<given-names><![CDATA[L.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Pacheco]]></surname>
<given-names><![CDATA[J.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
<contrib contrib-type="author">
<name>
<surname><![CDATA[Cadenas]]></surname>
<given-names><![CDATA[R.]]></given-names>
</name>
<xref ref-type="aff" rid="Aff"/>
</contrib>
</contrib-group>
<aff id="Af1">
<institution><![CDATA[,Universidad Popular del Cesar Facultad de Ciencias Básicas y Educación Departamento de Física]]></institution>
<addr-line><![CDATA[ ]]></addr-line>
<country>Colombia</country>
</aff>
<aff id="Af2">
<institution><![CDATA[,La Universidad del Zulia Facultad Experimental de Ciencias Departamento de Física]]></institution>
<addr-line><![CDATA[ ]]></addr-line>
<country>Venezuela</country>
</aff>
<pub-date pub-type="pub">
<day>00</day>
<month>12</month>
<year>2016</year>
</pub-date>
<pub-date pub-type="epub">
<day>00</day>
<month>12</month>
<year>2016</year>
</pub-date>
<volume>62</volume>
<numero>6</numero>
<fpage>526</fpage>
<lpage>529</lpage>
<copyright-statement/>
<copyright-year/>
<self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_arttext&amp;pid=S0035-001X2016000600526&amp;lng=en&amp;nrm=iso"></self-uri><self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_abstract&amp;pid=S0035-001X2016000600526&amp;lng=en&amp;nrm=iso"></self-uri><self-uri xlink:href="http://www.scielo.org.mx/scielo.php?script=sci_pdf&amp;pid=S0035-001X2016000600526&amp;lng=en&amp;nrm=iso"></self-uri><abstract abstract-type="short" xml:lang="en"><p><![CDATA[Abstract The calculation of physics parameters of semiconductor compounds is of great interest in order to evaluate their potential use in a wide class of optoelectronics devices. Different methods have been developed for these calculations, based on the Hartree-Fock Hamiltonian and on the Density Functional ones. Here, a theoretical study by using Crystal 06 software and ab initio Density Functional Theory and Hartree-Focks method with different basis functions was carried out in order to calculate the lattice energy and the energy gap of the MnGa 2 Se 4 magnetic semiconductor compound. It is shown that it is possible to calculate physics parameters of MnGa 2 Se 4 with the mentioned software but due to the multiple values reported in literature for the same parameter, it is not possible to determinate which of the bases used is more effective.]]></p></abstract>
<kwd-group>
<kwd lng="en"><![CDATA[MnGa2Se4 compound]]></kwd>
<kwd lng="en"><![CDATA[ab-initio calculations]]></kwd>
<kwd lng="en"><![CDATA[Hartree Fock]]></kwd>
<kwd lng="en"><![CDATA[density functional theory]]></kwd>
</kwd-group>
</article-meta>
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