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Photosensitization and singlet oxygen

Photosensitization and singlet oxygen Quantum chemistry

Spin-Exchange Internal Conversion (SEIC)

Simple proxies can predict diabatic and nonadiabatic couplings.

(more…)

By Mario Barbatti, 6 years ago
Photosensitization and singlet oxygen

Influence of Sugar on Triplet Decay of Thionucleosides

Functionalization of the sugar group can be used to control the triplet-decay rate of thionucleosides.

(more…)

By Mario Barbatti, 7 yearsJune 7, 2018 ago
Photosensitization and singlet oxygen

Singlet Oxygen: Rates Strongly Depend on Geometry

Simulations show how to maximize reaction rates for singlet oxygen generation.

(more…)

By Mario Barbatti, 8 yearsOctober 26, 2017 ago
Photosensitization and singlet oxygen

On the Decay of the Triplet State of Thionucleobases

Double-well shaped triplet state in thionucleobases can be used to tune singlet oxygen yields.

By Mario Barbatti, 8 yearsMay 5, 2017 ago
Photosensitization and singlet oxygen

Explaining the Photophysics of Thiothymines

Why does replacing different oxygens of thymine with sulfur cause distinct absorption and intersystem crossing?

By Mario Barbatti, 9 yearsAugust 4, 2016 ago

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