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Mostrando 1 - 20 resultados de 30 para a busca '(( decrease _ decrease the decrease ) OR ( decrease theory decrease of atoms ))~', tempo de busca: 1,16s Refinar Resultados
1
Publicado em 2022
Assuntos: “...Electronic structure of atoms & molecules...”
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Artigo
3
Publicado em 2013
“... dopant atoms resulted in a catalyst model of the type Ir@Ni(110) that was found to decrease the energy...”
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Artigo
9
Publicado em 2016
“... on the Density Functional Theory (DFT) allied to hybrid functional B3LYP. The Ba-doping caused increase...”
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Artigo
11
Publicado em 2017
“..., and that both processes occur on the nitrogen atom. The quantum theory of atoms in molecules (QTAIM...”
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Tese
12
Publicado em 2007
“...) theory. Aromaticity decreases as the number of heteroatoms in the aromatic molecule increases since...”
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Artigo
13
Publicado em 1999
“... density-functional theory. The adsorption stability decreases as the tellurium coverage increases. The...”
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Artigo
15
Publicado em 2022
“...We apply a first principles formalism based on the density functional theory to study structural...”
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Dissertação
17
Publicado em 2009
“...In this work, using first principles study based in framework of the density functional theory with...”
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Dissertação
20
Publicado em 2017
“...In the present work, we use first-principles calculations based Density Functional Theory...”
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Dissertação
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