Journal of Chemical Theory and Computation

Sousa, Julielson dos Santos. Gusmão, Eriosvaldo Florentino. Dias, Anne Kéllen de Nazaré dos Reis. Haiduke, Roberto Luiz Andrade. Relativistic Prolapse-Free Gaussian Basis Sets of Double- and Triple‑ζ Quality for s- and p‑Block Elements : (aug-)RPF-2Z and (aug‑)RPF-3Z. Washington, 2024. In press. Journal of Chemical Theory and Computation, Washington: American Chemical Society, In press, 2024.
Disponível em: https://doi.org/10.1021/acs.jctc.4c01211