Get started
Author

A. Canal Neto

Observed names: A Canal Neto, A. C. Neto, A.C Neto, A.C. Neto, Antônio Canal Neto
ORCID: 0000-0002-8556-618X
Observed ORCID: 0000-0002-8556-618X
OpenAlex ID: A5035765677
Contracted Gaussian basis sets for Douglas–Kroll–Hess calculations: Estimating scalar relativistic effects of some atomic and molecular properties
2009 · F. E. Jorge, A. Canal Neto, et al. · The Journal of Chemical Physics · 282
Gaussian basis set of double zeta quality for atoms Rb through Xe: application in non-relativistic and relativistic calculations of atomic and molecular properties
2010 · C.L. Barros, P.J.P. de Oliveira, et al. · Molecular Physics · 221
Gaussian basis sets for correlated wave functions. Hydrogen, helium, first- and second-row atoms
2005 · A. Canal Neto, E.P. Muniz, et al. · Journal of Molecular Structure THEOCHEM · 183
All-electron double zeta basis sets for the most fifth-row atoms: Application in DFT spectroscopic constant calculations
2013 · A. Canal Neto, F.E. Jorge · Chemical Physics Letters · 164
Augmented Gaussian basis sets of triple and quadruple zeta valence quality for the atoms H and from Li to Ar: Applications in HF, MP2, and DFT calculations of molecular dipole moment and dipole (hyper)polarizability
2007 · P.A. Fantin, P.L. Barbieri, et al. · Journal of Molecular Structure THEOCHEM · 83
Gaussian basis set of triple zeta valence quality for the atoms from K to Kr: Application in DFT and CCSD(T) calculations of molecular properties
2009 · S.F. Machado, G.G. Camiletti, et al. · Molecular Physics · 73
Extrapolation of Hartree–Fock and multiconfiguration self-consistent-field energies to the complete basis set limit
2016 · F. N. N. Pansini, A. C. Neto, et al. · Theoretical Chemistry Accounts · 57
Computational studies of the Ca12O12, Ti12O12, Fe12O12 and Zn12O12 nanocage clusters
2015 · Osmair Vital de Oliveira, José Maria Pires, et al. · Chemical Physics Letters · 53
Augmented Gaussian basis sets of double and triple zeta valence qualities for the atoms K and Sc–Kr: Applications in HF, MP2, and DFT calculations of molecular electric properties
2009 · G.G. Camiletti, A. Canal Neto, et al. · Journal of Molecular Structure THEOCHEM · 44
On the performance of various hierarchized bases in extrapolating the correlation energy to the complete basis set limit
2015 · F.N.N. Pansini, A.C. Neto, et al. · Chemical Physics Letters · 40
Augmented Gaussian basis set of double zeta valence quality for the atoms Rb and Y–Xe: Application in DFT calculations of molecular electric properties
2010 · P.J.P. de Oliveira, C.L. Barros, et al. · Journal of Molecular Structure THEOCHEM · 40
All-electron triple zeta basis sets for ZORA calculations: Application in studies of atoms and molecules
2021 · A. Canal Neto, I.B. Ferreira, et al. · Chemical Physics Letters · 26
Density functional theory calculations of optical rotation: Employment of ADZP and its comparison with other basis sets
2006 · Antônio Canal Neto, Francisco E. Jorge · Chirality · 22
Adapted Gaussian basis sets for atoms Cs to Lr based on the generator coordinate Hartree-Fock method
1998 · F. E. Jorge, P. R. Librelon, et al. · Journal of Computational Chemistry · 20
Some considerations about Gaussian basis sets for electric property calculations
2009 · Priscilla M. Arruda, A. Canal Neto, et al. · International Journal of Quantum Chemistry · 19
Gaussian basis set of sextuple zeta quality for hydrogen through argon
2011 · C.T. Campos, G.A. Ceolin, et al. · Chemical Physics Letters · 17
Theoretical study of the electronic structure and electrical properties of Al-doped niobium clusters
2020 · F.N.N. Pansini, M. de Campos, et al. · Chemical Physics · 16
Application of the Unified Singlet and Triplet Electron-Pair Extrapolation Scheme with Basis Set Rehierarchization to Tensorial Properties
2015 · F. N. N. Pansini, A. C. Neto, et al. · The Journal of Physical Chemistry A · 16
Effects of All-Electron Basis Sets and the Scalar Relativistic Corrections in the Structure and Electronic Properties of Niobium Clusters
2017 · F. N. N. Pansini, A. C. Neto, et al. · The Journal of Physical Chemistry A · 10
ZORA all-electron double zeta basis sets for the elements from H to Xe: application in atomic and molecular property calculations
2021 · Antônio Canal Neto, Amanda Z. de Oliveira, et al. · Journal of Molecular Modeling · 9
A new method for optimizing a set of nonlinear parameters: application in total Hartree–Fock atomic energy calculations
2020 · Francisco E. Jorge, Antônio Canal Neto · Theoretical Chemistry Accounts · 7
Gaussian basis sets for atomic and molecular calculations obtained from stochastic optimization
2016 · Thiago Mello dos Reis, Antônio Canal Neto, et al. · Computational and Theoretical Chemistry · 6
Calculations of Optical Rotation from Density Functional Theory
2007 · Antônio Canal Neto, Francisco Elias Jorge · Chinese Physics Letters · 6
An accurate Gaussian basis set for N2, BF, and CO molecules
2002 · F.E Jorge, A.C Neto · Journal of Molecular Structure THEOCHEM · 5
All-electron ZORA triple zeta basis sets for the elements Cs–La and Hf–Rn
2023 · Antônio Canal Neto, Francisco E. Jorge, et al. · Chinese Physics B · 4
Works count: 37
Citation count: 1,446
H-index: 16
I10-index: 19
Year
Topic
Type