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Supporting Information for:

COLOCAR AQUI O TITULO FINAL DO ARTIGO

Vinicius Piccoli¹, ** Agílio Pádua², **Leandro Martínez¹,*

¹Institute of Chemistry and Center for Computing in Engineering & Science, Universidade Estadual de Campinas (UNICAMP), 13083-861 Campinas, SP, Brazil ²XXXXXXXXXXXXXX

Leandro Martínez: lmartine@unicamp.br Institute of Chemistry, Universidade Estadual de Campinas (UNICAMP). 13083-970, Campinas, SP. Brazil Group Website

Contents

Supplementary Tables:

  • Table SX. table description.

Supplementary Figures

  • Figures Sx–Sx. Description of the figures.

Acknowledgements (adicionar agradecimentos adicionais necessários)

The authors acknowledge the financial support of Fapesp (2018/24293-0, 2018/14274-9, 2020/04916-3), and CAPES 206-04/092018. Research developed with the Coaraci Supercomputer for computer time (Fapesp grant 2019/17874-0) and the Center for Computing in Engineering and Sciences at Unicamp (Fapesp grant 2013/08293-7)