Relativistic Four-Component Potential Energy Curves for the Lowest 23 Covalent States of Molecular Bromine (Br2)
Gomes, José da Silva, Gargano, Ricardo, Martins, João B. L, M. de Macedo, Luiz Guilherme
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (07.08.2014)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (07.08.2014)
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The interaction of CCl4 with Ng (Ng = He, Ne, Ar), O2, D2O and ND3: rovibrational energies, spectroscopic constants and theoretical calculations
de Oliveira, Rhuiago M., Roncaratti, Luiz F., de Macedo, Luiz Guilherme M., Gargano, Ricardo
Published in Journal of molecular modeling (01.03.2017)
Published in Journal of molecular modeling (01.03.2017)
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Relativistic effects for the superheavy reaction Og + 2Ts2 → OgTs4 (Td or D4h): dramatic relativistic effects for atomization energy of superheavy Oganesson tetratennesside OgTs4 and prediction of the existence of tetrahedral OgTs4
Malli, Gulzari L., Siegert, Martin, de Macedo, Luiz Guilherme M., Loveland, Walter
Published in Theoretical chemistry accounts (01.06.2021)
Published in Theoretical chemistry accounts (01.06.2021)
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Ab Initio correlated all electron Dirac-Fock calculations for eka-francium fluoride (E119F)
Miranda, Patrícia S., Mendes, Anna Paula S., Gomes, Jose S., Alves, Claudio N., Souza, Aguinaldo R. de, Sambrano, Julio R., Gargano, Ricardo, Macedo, Luiz Guilherme M. de
Published in Journal of the Brazilian Chemical Society (01.06.2012)
Published in Journal of the Brazilian Chemical Society (01.06.2012)
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4-Component correlated all-electron study on Eka-actinium Fluoride (E121F) including Gaunt interaction: Accurate analytical form, bonding and influence on rovibrational spectra
Amador, Davi H.T., de Oliveira, Heibbe C.B., Sambrano, Julio R., Gargano, Ricardo, de Macedo, Luiz Guilherme M.
Published in Chemical physics letters (01.10.2016)
Published in Chemical physics letters (01.10.2016)
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Journal Article
The interaction of CCl 4 with Ng (Ng = He, Ne, Ar), O 2 , D 2 O and ND 3 : rovibrational energies, spectroscopic constants and theoretical calculations
de Oliveira, Rhuiago M, Roncaratti, Luiz F, de Macedo, Luiz Guilherme M, Gargano, Ricardo
Published in Journal of molecular modeling (01.03.2017)
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Published in Journal of molecular modeling (01.03.2017)
Journal Article
Dramatic relativistic and magnetic Breit effects for the superheavy reaction Og + 3Ts$_2$ -> OgTs$_6$: Prediction of atomization energy and the existence of the superheavy octahedral Oganesson hexatennesside OgTs$_6
Malli, Gulzari, Siegert, Martin, De Macedo, Luiz Guilherme M, Loveland, Walter
Year of Publication 14.01.2021
Year of Publication 14.01.2021
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