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singlet oxygen

Photochemistry and photophysics

Internal Conversion Pathways of Resveratrol

Discovering the photophysics of resveratrol opens up its use in pharmaceutical innovations.

(more…)
By Mario Barbatti, 10 monthsAugust 8, 2024 ago
Photosensitization and singlet oxygen Quantum chemistry

Spin-Exchange Internal Conversion (SEIC)

Simple proxies can predict diabatic and nonadiabatic couplings.

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By Mario Barbatti, 6 years 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
Methods and Software

A Kinetic Model for Singlet Oxygen Photogeneration

Reaction rates for energy transfer calculated from first principles.

By Mario Barbatti, 8 yearsOctober 12, 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

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