Publications of Marcos Casanova-Páez

Casanova-Páez, M.; Neese, F.: Core-Excited States for Open-Shell Systems in Similarity-Transformed Equation-of-Motion Theory. Journal of Chemical Theory and Computation 21 (3), pp. 1306 - 1321 (2025)

Casanova-Páez, M.; Neese, F.: Assessment of the similarity-transformed equation of motion (STEOM) for open-shell organic and transition metal molecules. The Journal of Chemical Physics 161 (14), 144120 (2024)