Fitting Multiplet Simulations to L-edge XAS spectra of transition metal complexes using an adaptive grid algorithm and optimized radial functions

Fitting Multiplet Simulations to L-edge XAS spectra of transition metal complexes using an adaptive grid algorithm and optimized radial functions

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Veröffentlicht in:Inorganic chemistry 2023-02, Vol.62 (9), p.3738-3760
Hauptverfasser: Herrera-Yáñez, María, Guerrero-Cruz, J. Alberto, Ghiasi, Mahnaz, Elnaggar, Hebatalla, de la Torre-Rangel, Andrea, Bernal-Guzmán, L. Alejandra, Flores-Moreno, Roberto, de Groot, Frank, Delgado-Jaime, Mario
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container_end_page 3760
container_issue 9
container_start_page 3738
container_title Inorganic chemistry
container_volume 62
creator Herrera-Yáñez, María
Guerrero-Cruz, J. Alberto
Ghiasi, Mahnaz
Elnaggar, Hebatalla
de la Torre-Rangel, Andrea
Bernal-Guzmán, L. Alejandra
Flores-Moreno, Roberto
de Groot, Frank
Delgado-Jaime, Mario
description
doi_str_mv 10.1021/acs.inorgchem.2c02830
format Article
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title Fitting Multiplet Simulations to L-edge XAS spectra of transition metal complexes using an adaptive grid algorithm and optimized radial functions
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