Structural Properties Electronic and Vibrational Crystals Aspartic Acid (Asp): Computer Simulations in Formalism DFT

FundaÃÃo Cearense de Apoio ao Desenvolvimento Cientifico e TecnolÃgico === Computer simulations within the Density Functional Theory (DFT) formalism were accomplished to find the structural, electronic and vibrational properties of aspartic acid (Asp) crystals in the L-anhydrous, L-monohydrated, and...

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Bibliographic Details
Main Author: Agmael MendonÃa Silva
Other Authors: Ewerton Wagner Santos Caetano
Format: Others
Language:Portuguese
Published: Universidade Federal do Cearà 2015
Subjects:
Online Access:http://www.teses.ufc.br/tde_busca/arquivo.php?codArquivo=14934

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