Femtosecond Core-Level Spectroscopy Reveals Involvement of Triplet States in the Gas-Phase Photodissociation of Fe(CO)5

J Troß, JE Arias-Martinez, K Carter-Fenk… - Journal of the …, 2024 - ACS Publications
Excitation of iron pentacarbonyl [Fe (CO) 5], a prototypical photocatalyst, at 266 nm causes
the sequential loss of two CO ligands in the gas phase, creating catalytically active …

The Role of Spin–Orbit Coupling in the Linear Absorption Spectrum and Intersystem Crossing Rate Coefficients of Ruthenium Polypyridyl Dyes

JJ Talbot, TP Cheshire, SJ Cotton… - The Journal of …, 2024 - ACS Publications
The successful use of molecular dyes for solar energy conversion requires efficient charge
injection, which in turn requires the formation of states with sufficiently long lifetimes (eg …

Cooking core spectroscopy with the finest ingredients: Computational recipes based on orbital-optimized references

JE Arias Martinez - 2023 - escholarship.org
The development of predictive computational methods to simulate, and thus interpret the
phenomena relevant to core spectroscopies is a vibrant and flourishing field. Until recently …

[图书][B] Cooking Core Spectroscopy With the Finest Ingredients: Computational Recipes Based on Orbital-Optimized References

JEA Martinez - 2023 - search.proquest.com
The development of predictive computational methods to simulate, and thus interpret the
phenomena relevant to core spectroscopies is a vibrant and flourishing field. Until recently …