Density functional study of oxo-hydroxy
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Tiziana Marino; Nino Russo; Marirosa Toscano
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Article
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1997
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John Wiley and Sons
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English
⚖ 142 KB
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The four lowest energy oxo-hydroxy tautomers of 5-fluorouracil have been studied by using the linear combination of Gaussian-type orbital᎐nonlocal spin Ž . density LCGTO-NLSD method with Gaussian DZVP basis set and employing different exchange᎐correlation functionals for taking into account the nonl