All-electron double zeta basis sets for the most fifth-row atoms: Application in DFT spectroscopic constant calculations von Canal Neto, A., Jorge, F.E.

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TDDFT calculations and photoacoustic spectroscopy experiments used to identify phenolic acid functional biomolecules in Brazilian tropical fruits in natura von Lourenço Neto, M., Agra, K.L., Suassuna Filho, J., Jorge, F.E.

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Augmented Gaussian basis sets for the elements K, Sc–Kr, Rb, and Y–Xe: Application in HF, MP2, and DFT calculations of molecular electric properties von Martins, L.S.C., de Souza, F.A.L., Ceolin, G.A., Jorge, F.E., de Berrêdo, R.C., Campos, C.T.

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Gaussian basis set of sextuple zeta quality for hydrogen through argon von Campos, C.T., Ceolin, G.A., Canal Neto, A., Jorge, F.E., Pansini, F.N.N.

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Structural, electronic, electrical, and magnetic properties of Rh (1 ≤ n ≤ 13) clusters von de Oliveira, A.Z., Jorge, F.E.

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Augmented Gaussian basis set of quintuple zeta valence quality for H and from Li to Ar: Applications in DFT calculations of molecular electric properties von de Oliveira, P.J.P., Jorge, F.E.

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All-electron triple zeta basis sets for ZORA calculations: Application in studies of atoms and molecules von Canal Neto, A., Ferreira, I.B., Jorge, F.E., de Oliveira, A.Z.

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ZORA double zeta basis sets for fifth row elements: Application in studies of electronic structures of atoms and molecules von Centoducatte, R., de Oliveira, A.Z., Jorge, F.E., Camiletti, G.G.

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Structural, electronic, electrical, and magnetic properties of Rhn (1 ≤ n ≤ 13) clusters von de Oliveira, A.Z., Jorge, F.E.

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All-electron double zeta basis sets for the lanthanides: Application in atomic and molecular property calculations von Jorge, F.E., Martins, L.S.C., Franco, M.L.

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All-electron triple zeta basis sets for the actinides von de Oliveira, A.Z., Campos, C.T., Jorge, F.E., Ferreira, I.B., Fantin, P.A.

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Gaussian basis set of double zeta quality for atoms K through Kr: Application in DFT calculations of molecular properties von Camiletti, G.G, Machado, S.F, Jorge, F.E

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Segmented all-electron Gaussian basis sets of double and triple zeta qualities for Fr, Ra, and Ac von Campos, C.T., de Oliveira, A.Z., Ferreira, I.B., Jorge, F.E., Martins, L.S.C.

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PVDF containing different oxide nanoparticles for application in oil and gas pipelines von Santos, B.P.S, Arias, J.J.R, Jorge, F.E, Santos, R.E.P.D, Fernandes, B.S, Candido, L.S, Peres, A.C.C, Chaves, E.G, Marques, M.F.V

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PVDF containing different oxide nanoparticles for application in oil and gas pipelines von Santos, B.P.S., Arias, J.J.R., Jorge, F.E., Santos, R.É.P.D., Fernandes, B.S., Candido, L.S., Peres, A.C.C., Chaves, É.G., Marques, M.F.V.

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Basis set convergence on optical rotation DFT calculations von Campos, C.T., Jorge, F.E., Silva, T.P., Coppo, M.R.

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Gaussian basis sets of 5 zeta valence quality for correlated wave functions von Jorge, F.E., Sagrillo, P.S., de Oliveira, A.R.

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An augmented Gaussian basis set for calculations of molecular polarizabilities on platinum compounds von de Berrêdo, R.C., Jorge, F.E., Jorge, Sara S., Centoducatte, R.

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Gaussian basis sets for correlated wave functions. Hydrogen, helium, first- and second-row atoms von Canal Neto, A., Muniz, E.P., Centoducatte, R., Jorge, F.E.

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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... von Camiletti, G.G., Canal Neto, A., Jorge, F.E., Machado, S.F.

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