Lv61
1990 积分 2023-10-09 加入
Violation of Hund’s rule in molecules: Predicting the excited-state energy inversion by TD-DFT with double-hybrid methods
1个月前
已完结
Hypsochromic Shift of Multiple‐Resonance‐Induced Thermally Activated Delayed Fluorescence by Oxygen Atom Incorporation
1个月前
已完结
Chemical Strategies for Modifying Carbonyl/Nitrogen‐Based MR‐TADF Materials toward Narrowband Emission
1个月前
已完结
Multi-resonance thermally activated delayed fluorescence molecules with intramolecular-lock: theoretical design and performance prediction
1个月前
已完结
Narrowband TADF emitters with high utilization of triplet excitons: theoretical insights and molecular design
1个月前
已完结
Theoretical Study for Constructing Red Multiple-Resonance Thermally Activated Delayed Fluorescence Molecules with Narrowband Emission by Donor Engineering Strategy
1个月前
已完结
Differences in carbonyl groups and boron acceptors in MR‐TADF and full‐color emission merging strategies: A theoretical study
1个月前
已完结
A theoretical investigation of heavy atom and oxidation effects in MR-TADF emitters for OLEDs: a combined DFT, double hybrid DFT, CCSD, and QM/MM approaches
1个月前
已完结
Three States Involving Vibronic Resonance is a Key to Enhancing Reverse Intersystem Crossing Dynamics of an Organoboron-Based Ultrapure Blue Emitter
1个月前
已完结
Organophosphine‐Sandwiched Copper Iodide Cluster Enables Charge Trapping
2个月前
已完结
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