Works by de Macedo, Luiz Guilherme Machado

Results: 8

On the Angular Distribution of the H+Li2 Cross Sections: a Converged Time-Independent Quantum Scattering Study.

Published in:

Scientific Reports, 2018, v. 8, n. 1, p. 1, doi. 10.1038/s41598-018-19233-0

By:

Vila, Henrique Vieira Rivera;
Ribeiro, Luiz Antônio;
Macedo, Luiz Guilherme Machado de;
Gargano, Ricardo

Publication type:

Article

Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular I2- anion including breit interactions.

Published in:

Journal of Molecular Modeling, 2023, v. 29, n. 7, p. 1, doi. 10.1007/s00894-023-05564-x

By:

de Macedo, Luiz Guilherme Machado;
de Castro Vieira, Yasmin Celen;
de Oliveira, Rhuiago Mendes;
Gargano, Ricardo

Publication type:

Article

Electronic and dynamical properties of non-covalent diatomic aggregates formed by He with neutral and ionic Li and Be.

Published in:

Journal of Molecular Modeling, 2023, v. 29, n. 6, p. 1, doi. 10.1007/s00894-023-05512-9

By:

de Jesus, Guilherme Carlos Carvalho;
Costa, Caio Vinícius Sousa;
de Macedo, Luiz Guilherme Machado;
de Oliveira Neto, Pedro Henrique;
Pirani, Fernando;
Gargano, Ricardo

Publication type:

Article

Correction to: Fully relativistic study of polyatomic closed shell E121X3 (X = F, Cl, Br) molecules: effects of Gaunt interaction, relativistic effects and advantages of an exact-two component (X2C) hamiltonian.

Published in:

2022

By:

Sena Pinheiro, Alan;
Gargano, Ricardo;
dos Santos, Paulo Henrique Gomes;
de Macedo, Luiz Guilherme Machado

Publication type:

Correction Notice

Fully relativistic study of polyatomic closed shell E121X3 (X = F, Cl, Br) molecules: effects of Gaunt interaction, relativistic effects and advantages of an exact-two component (X2C) hamiltonian.

Published in:

Journal of Molecular Modeling, 2021, v. 27, n. 9, p. 1, doi. 10.1007/s00894-021-04861-7

By:

Pinheiro, Alan Sena;
Gargano, Ricardo;
Santos, Paulo Henrique Gomes dos;
de Macedo, Luiz Guilherme Machado

Publication type:

Article

Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular F2− anion including Breit interactions.

Published in:

Journal of Molecular Modeling, 2021, v. 27, n. 8, p. 1, doi. 10.1007/s00894-021-04846-6

By:

de Macedo, Luiz Guilherme Machado;
Wanzeler, Heracles Pereira;
Dias, Gabriel Henrique Lange;
Gargano, Ricardo

Publication type:

Article

A Detailed Study of Electronic and Dynamic Properties of Noble Gas–Oxygen Molecule Adducts.

Published in:

Molecules, 2022, v. 27, n. 21, p. 7409, doi. 10.3390/molecules27217409

By:

Costa, Caio Vinícius Sousa;
de Jesus, Guilherme Carlos Carvalho;
de Macedo, Luiz Guilherme Machado;
Pirani, Fernando;
Gargano, Ricardo

Publication type:

Article

A Spectroscopic Validation of the Improved Lennard–Jones Model.

Published in:

Molecules, 2021, v. 26, n. 13, p. 3906, doi. 10.3390/molecules26133906

By:

de Oliveira, Rhuiago Mendes;
Machado de Macedo, Luiz Guilherme;
da Cunha, Thiago Ferreira;
Pirani, Fernando;
Gargano, Ricardo

Publication type:

Article

Works by de Macedo, Luiz Guilherme Machado

On the Angular Distribution of the H+Li<sub>2</sub> Cross Sections: a Converged Time-Independent Quantum Scattering Study.

Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular I2- anion including breit interactions.

Electronic and dynamical properties of non-covalent diatomic aggregates formed by He with neutral and ionic Li and Be.

Correction to: Fully relativistic study of polyatomic closed shell E121X<sub>3</sub> (X = F, Cl, Br) molecules: effects of Gaunt interaction, relativistic effects and advantages of an exact-two component (X2C) hamiltonian.

Fully relativistic study of polyatomic closed shell E121X<sub>3</sub> (X = F, Cl, Br) molecules: effects of Gaunt interaction, relativistic effects and advantages of an exact-two component (X2C) hamiltonian.

Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular F2− anion including Breit interactions.

A Detailed Study of Electronic and Dynamic Properties of Noble Gas–Oxygen Molecule Adducts.

A Spectroscopic Validation of the Improved Lennard–Jones Model.