Narrowing the error in electron correlation calculations by basis set re-hierarchization and use of the unified singlet and triplet electron-pair extrapolation scheme … AJC Varandas, FNN Pansini The Journal of chemical physics 141 (22), 224113, 2014 | 75 | 2014 |

Extrapolation of Hartree–Fock and multiconfiguration self-consistent-field energies to the complete basis set limit FNN Pansini, AC Neto, AJC Varandas Theoretical Chemistry Accounts 135 (12), 1-6, 2016 | 28 | 2016 |

On the performance of various hierarchized bases in extrapolating the correlation energy to the complete basis set limit FNN Pansini, AC Neto, AJC Varandas Chemical Physics Letters 641, 90-96, 2015 | 25 | 2015 |

Toward a unified single-parameter extrapolation scheme for the correlation energy: Systems formed by atoms of hydrogen through neon FNN Pansini, AJC Varandas Chemical Physics Letters 631, 70-77, 2015 | 23 | 2015 |

Gaussian basis set of sextuple zeta quality for hydrogen through argon CT Campos, GA Ceolin, AC Neto, FE Jorge, FNN Pansini Chemical Physics Letters 516 (4-6), 125-130, 2011 | 17 | 2011 |

Application of the unified singlet and triplet electron-pair extrapolation scheme with basis set rehierarchization to tensorial properties FNN Pansini, AC Neto, AJC Varandas The Journal of Physical Chemistry A 119 (7), 1208-1217, 2015 | 16 | 2015 |

Trends in the spin states and mean static dipole polarizability of the group VIIIA metallocenes FNN Pansini, FAL de Souza The Journal of Physical Chemistry A 120 (17), 2771-2778, 2016 | 15 | 2016 |

Molecules under external electric field: On the changes in the electronic structure and validity limits of the theoretical predictions FNN Pansini, FAL De Souza, CT Campos Journal of Computational Chemistry 39 (20), 1561-1567, 2018 | 13 | 2018 |

Effects of all-electron basis sets and the scalar relativistic corrections in the structure and electronic properties of niobium clusters FNN Pansini, AC Neto, M de Campos, RM de Aquino The Journal of Physical Chemistry A 121 (30), 5728-5734, 2017 | 8 | 2017 |

Theoretical study of the electronic structure and electrical properties of Al-doped niobium clusters FNN Pansini, M de Campos, AC Neto, CS Sergio Chemical Physics 535, 110778, 2020 | 7 | 2020 |

Conjunto de bases gaussianas universal para Átomos de k até kr FNN Pansini Master's thesis, Universidade Federal do Espírito Santo, 2013 | 3 | 2013 |

Optimized Structural Data at the Complete Basis Set Limit via Successive Quadratic Minimizations FNN Pansini, VC Mota, AJC Varandas The Journal of Physical Chemistry A 125 (50), 10657-10666, 2021 | 2 | 2021 |

Optimal diffuse augmented atomic basis sets for extrapolation of the correlation energy AJC Varandas, FNN Pansini International Journal of Quantum Chemistry 120 (7), e26135, 2020 | 2 | 2020 |

Optimal basis sets for CBS extrapolation of the correlation energy: oVxZ and oV (x+ d) Z AJC Varandas, FNN Pansini The Journal of Chemical Physics 150 (15), 154106, 2019 | 2 | 2019 |

On the solvation model and infrared spectroscopy of liquid water FNN Pansini, AJC Varandas Chemical Physics Letters, 139739, 2022 | 1 | 2022 |

NMR spectral parameters of open-and closed-shell graphene nanoflakes: Orbital and hyperfine contributions FAL de Souza, FNN Pansini, AR Ambrozio, JCC Freitas, WL Scopel Carbon 191, 374-383, 2022 | 1 | 2022 |

Size and shape effects on the stability, electronic structure, and Raman spectroscopy of (SrO)_{n} nanoclustersLF Filho, FNN Pansini, FAL de Souza International Journal of Quantum Chemistry 121 (12), e26642, 2021 | 1 | 2021 |

A comprehensive study of the reduction of nitrate on natural FeTiO3: Photocatalysis and DFT calculations JE Silveira, AS de Souza, FNN Pansini, AR Ribeiro, WL Scopel, JA Zazo, ... Separation and Purification Technology, 122570, 2022 | | 2022 |

Re-Hierarquização e Extrapolações para o Limite do Conjunto de Base Completo FNN Pansini Tese de doutorado, 113, 2015 | | 2015 |