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On the Origin of the Shift Between Vertical Excitation and Band Maximum in Molecular Photoabsorption
Shuming Bai
,
Ritam Mansour
,
Ljiljana Stojanović
,
Josene Toldo
,
Mario Barbatti
Journal articles
hal-02612358v1
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New Insights into the State Trapping of UV-Excited 2 Thymine 3
Ljiljana Stojanović
,
Shuming Bai
,
Jayashree Nagesh
,
Artur F Izmaylov
,
Rachel Crespo-Otero
,
et al.
Journal articles
hal-02288823v1
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Divide-to-Conquer: A Kinetic Model for Singlet Oxygen Photosensitization
Shuming Bai
,
Mario Barbatti
Journal articles
hal-02288768v1
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Evaluation of Spin-Orbit Couplings with Linear-Response Time-Dependent Density Functional Methods
Xing Gao
,
Shuming Bai
,
Daniele Fazzi
,
Thomas Niehaus
,
Mario Barbatti
,
et al.
Journal articles
hal-02288755v1
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Why Replacing Different Oxygen of Thymine with Sulfur Causes Distinct Absorption and Intersystem Crossing?
Shuming Bai
,
Mario Barbatti
Journal articles
hal-02288816v1
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Mechanism of Spin-Exchange Internal Conversion: Practical Proxies for Diabatic and Nonadiabatic Couplings
Shuming Bai
,
Mario Barbatti
Journal articles
hal-02288617v1
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Spatial Factors for Triplet Fusion Reaction of Singlet Oxygen Photosensitization
Shuming Bai
,
Mario Barbatti
Journal articles
hal-02288769v1
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Why Replacing Different Oxygens of Thymine with Sulfur Causes Distinct Absorption and Intersystem Crossing
Shuming Bai
,
Mario Barbatti
Journal articles
hal-01415147v1
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On the Decay of the Triplet State of Thionucleobases
Shuming Bai
,
Mario Barbatti
Journal articles
hal-02288760v1
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New Insights into the State Trapping of UV-Excited Thymine
Ljiljana Stojanović
,
Shuming Bai
,
Jayashree Nagesh
,
Artur F. Izmaylov
,
Rachel Crespo-Otero
,
et al.
Molecules, 2016, 21 (11), pp.1603
Journal articles
hal-01415840v1
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Intersystem crossing dynamics in singly substituted thiouracil studied by time-resolved photoelectron spectroscopy: Micro-environmental effects due to sulfur position
Abed Mohamadzade
,
Shuming Bai
,
Mario Barbatti
,
Susanne Ullrich
Chemical Physics, 2018, 515, pp.572-579
Journal articles
hal-01965453v1
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Mechanism of Enhanced Triplet Decay of Thionucleobase by Glycosylation and Rate-Modulating Strategies
Shuming Bai
,
Mario Barbatti
Physical Chemistry Chemical Physics, 2018, 20 (24), pp.16428-16436
Journal articles
hal-01965457v1
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