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Diego Paschoal
ORCID
Publication Activity (10 Years)
Years Active: 2010-2016
Publications (10 Years): 1
Top Topics
Quantum Mechanics
Structural Information
Small Number
Lower Level
Top Venues
J. Comput. Chem.
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Publications
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Diego Paschoal
,
Célia Fonseca Guerra
,
Marcone Augusto L. de Oliveira
,
Teodorico C. Ramalho
,
Hélio F. Dos Santos
Predicting Pt-195 NMR chemical shift using new relativistic all-electron basis set.
J. Comput. Chem.
37 (26) (2016)
Diego Paschoal
,
Bruna L. Marcial
,
Juliana Fedoce Lopes
,
Wagner B. De Almeida
,
Hélio F. Dos Santos
The role of the basis set and the level of quantum mechanical theory in the prediction of the structure and reactivity of cisplatin.
J. Comput. Chem.
33 (29) (2012)
Diego Paschoal
,
Marcello F. Costa
,
Georgia M. A. Junqueira
,
Hélio F. Dos Santos
Gaussian basis sets for ab initio calculation of NLO properties of polyatomic molecules.
J. Comput. Methods Sci. Eng.
10 (3-6) (2010)