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<identifier>oai:HAL:hal-01398278v1</identifier>
<datestamp>2017-12-21</datestamp>
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<publisher>HAL CCSD</publisher>
<title lang=en>Calculation of elongated carbon structures with Density Functional Theory and fast Poisson solver</title>
<creator>Zuvovski, Michael</creator>
<creator>Boag, Amir</creator>
<creator>Slepyan, Gregory</creator>
<creator>Poullet, Pascal</creator>
<creator>Natan, Amir</creator>
<contributor>Department of Electrical Engineering ; Tel Aviv University [Tel Aviv]</contributor>
<contributor>Laboratoire de Mathématiques Informatique et Applications (LAMIA) ; Université des Antilles et de la Guyane (UAG)</contributor>
<description>International audience</description>
<source>2015 International Conference on Electromagnetics in Advanced Applications, ICEAA 2015</source>
<coverage>Torino, Italy</coverage>
<identifier>hal-01398278</identifier>
<identifier>https://hal.archives-ouvertes.fr/hal-01398278</identifier>
<source>https://hal.archives-ouvertes.fr/hal-01398278</source>
<source>2015 International Conference on Electromagnetics in Advanced Applications, ICEAA 2015, Sep 2015, Torino, Italy. pp.903-906, 2015</source>
<language>en</language>
<subject>[MATH.MATH-NA] Mathematics [math]/Numerical Analysis [math.NA]</subject>
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<type>Conference papers</type>
<description lang=en>The solution of the Poisson equation is an essential stage in the calculation of quantum properties of materials as it appears both in the electrostatic Hartree term and in the Fock exchange operator. We discuss here an integral method for the calculation of Poisson potential and demonstrate its integration with a Density Functional Theory (DFT) code. We show some results on elongated carbon chains.</description>
<date>2015-09-07</date>
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