Original Publications

Thermally Distinguishable Polyhedral Shapes in Chemistry: 6- and 7-Coordination

Gabriel H. L. Munguba, Mateus F. da Silva, Gabriel A. Urquiza-Carvalho, Frederico T. Silva, and Alfredo M. Simas

ACS Omega 2025

Decision Trees for the Recognition of Metal-Centered Chirality in Coordination Complexes

Gabriel H. L. Munguba, Mateus F. da Silva, Gabriel A. Urquiza-Carvalho, Frederico T. Silva, and Alfredo M. Simas

Journal of Comput Chemistry 2025, 46: e70025

Impact of stereoisomer multiplicity on the luminescence analysis of europium complexes

Gabriel H. L. Munguba, José Diogo L. Dutra, and Alfredo M. Simas

Optical Materials 2023, 145, 114359

The complex build algorithm to set up starting structures of lanthanoid complexes with stereochemical control for molecular modeling

Gabriel H. L. Munguba, Gabriel A. Urquiza-Carvalho, Frederico T. Silva, and Alfredo M. Simas

https://www.nature.com/articles/s41598-021-99525-0

Stereoisomerism in Lanthanide Complexes: Enumeration, Chirality, Identification, Random Coordination Ratios

Frederico Teixeira Silva, Sóstenes Luiz Soares Lins and Alfredo Mayall Simas

Inorganic Chemistry 2018, 57, 17, 10557–10567