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  • × Sociedade Brasileira de Quimica
  • × DFT
 全选  【符合条件的数据共：26条】

1 Hybrid Self-Assembled Materials Constituted by Ferromagnetic Nanoparticles and Tannic Acid: a Theoretical and Experimental Investigation [期刊论文]

来源：Journal of the Brazilian Chemical Society , 2016

作者:Espinoza-Castañeda, Marisol;Lima, Francisco das Chagas A.;Chaves, Mariana H.;等

关键词: hybrid materials;magnetite;...

使用许可:Unknown

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2 The Effect of Gamma-Al2O3 Support on the NO Adsorption on Pd4 Cluster [期刊论文]

来源：Journal of the Brazilian Chemical Society , 2016

作者:Almeida, Wagner B. de;Carneiro, José W. M.;Universidade do Estado do Rio de Janeiro, Rio de Janeiro, Brazil;等

关键词: Pd clusters;DFT;...

使用许可:Unknown

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3 THEORETICAL STUDY OF THE BINUCLEAR COMPLEXES OF MANGANESE (II) WITH LIGAND 2-HYDROXYBENZYLGLYCINE, POSSIBLES MIMICS FOR CATECHOL OXIDASE [期刊论文]

来源：Química Nova , 2016

作者:Casellato, Annelise;Universidade Federal do Rio de Janeiro, Rio de Janeiro, Brazil;Silva, Everton T. da;等

关键词: catechol oxidase;complexes of manganese;...

使用许可:Unknown

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4 Related properties to acidity and basicity from computational chemistry approach [期刊论文]

来源：Química Nova , 2014

作者:Firme, Caio L.;Universidade Federal do Rio Grande do Norte, Natal, Brasil;Lima, Kássio M. G.;等

关键词:acids/conjugate bases;DFT;...

使用许可:Unknown

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5 Related properties to acidity and basicity from computational chemistry approach [期刊论文]

来源：Quimica nova , 2014

作者:Firme, Caio L., Lima, Kássio M. G., Silva, Sérgio R. B.

关键词:acids/conjugate bases;DFT;...

使用许可:CC BY

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6 Influence of the structure on the antioxidant activity of tetradentate schiff bases and their copper(II) complexes: possible mechanisms [期刊论文]

来源：Journal of the Brazilian Chemical Society , 2013

作者:Lolic, Aleksandar D.;Tesic, Zivoslav Lj.;Baosic, Rada M.;等

关键词:antioxidant activity;antioxidant mechanism;...

使用许可:Unknown

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