Study of the optical and magnetic properties of pyrimidine in water combining PCM and QM/MM methodologies
Abstract
The
* Corresponding authors
a Instituto de Física, Universidade Federal de Alagoas, Maceió, AL, Brazil
b
Instituto de Física, Universidade de São Paulo, CP 66318, São Paulo, SP, Brazil
E-mail:
canuto@if.usp.br
c Departamento de Ciências Exatas e Naturais, Universidade Federal do Pará, Marabá, PA, Brazil
The
V. Manzoni, M. L. Lyra, R. M. Gester, K. Coutinho and S. Canuto, Phys. Chem. Chem. Phys., 2010, 12, 14023 DOI: 10.1039/C0CP00122H
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