Xinyu Song

Jinan, 250100, China

Last Updated: 09/26/2026

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Found 52 publications

Predicting Excited-State Energies from Ground-State Descriptors in Thermally Fluctuating π-Conjugated Molecules.

Predicting Excited-State Energies from Ground-State Descriptors in Thermally Fluctuating π-Conjugated Molecules.

Journal: Journal of chemical theory and computation

Published: July 07, 2026

Synergistic dual steric-electronic effects of bay-substituents on singlet fission in perylene diimide derivatives.

Synergistic dual steric-electronic effects of bay-substituents on singlet fission in perylene diimide derivatives.

Journal: Physical chemistry chemical physics : PCCP

Published: July 07, 2026

Emergent Supermonomer Directs Spatially Separated Triplet Pair Generation in Dynamic Oligomers.

Emergent Supermonomer Directs Spatially Separated Triplet Pair Generation in Dynamic Oligomers.

Journal: Angewandte Chemie (International ed. in English)

Published: May 05, 2026

Orbital Topology Overcomes Energetic Constraints: Conjugation Expansion Breaks the Inverse Relationship between SOMO Splitting and Spin Coupling for Giant Ferromagnetic Coupling in Organic Diradicals.

Orbital Topology Overcomes Energetic Constraints: Conjugation Expansion Breaks the Inverse Relationship between SOMO Splitting and Spin Coupling for Giant Ferromagnetic Coupling in Organic Diradicals.

Journal: The journal of physical chemistry letters

Published: March 16, 2026

Cross-plane magnetic coupling in carbon-based diradicals with one-electron σ-bond regulated by conjugative substituent engineering.

Cross-plane magnetic coupling in carbon-based diradicals with one-electron σ-bond regulated by conjugative substituent engineering.

Journal: Physical chemistry chemical physics : PCCP

Published: February 02, 2026

Harnessing the charge-transfer-to-solvent state of aqueous triiodide: A strategy to mitigate I2 trapping and enhance hydrated electron yield.

Harnessing the charge-transfer-to-solvent state of aqueous triiodide: A strategy to mitigate I2 trapping and enhance hydrated electron yield.

Journal: The Journal of chemical physics

Published: January 10, 2026

Polyene Bond Resonances Drive Intramolecular Singlet Fission in Diphenylhexatriene Dimers.

Polyene Bond Resonances Drive Intramolecular Singlet Fission in Diphenylhexatriene Dimers.

Journal: The journal of physical chemistry letters

Published: January 07, 2026

Metastable π-Lithium Supermolecule Entities Govern Voltage in Electron-Rich Electrolytes: Orbital Energetics as Predictive Voltage Descriptors.

Metastable π-Lithium Supermolecule Entities Govern Voltage in Electron-Rich Electrolytes: Orbital Energetics as Predictive Voltage Descriptors.

Journal: Advanced science (Weinheim, Baden-Wurttemberg, Germany)

Published: September 01, 2025

Watching Vibrations Steer Electrons: Ultrafast Vibration-Induced Absorption Switching through Real-Time Orbital Modulation in a Confined Quantum System.

Watching Vibrations Steer Electrons: Ultrafast Vibration-Induced Absorption Switching through Real-Time Orbital Modulation in a Confined Quantum System.

Journal: The journal of physical chemistry letters

Published: June 20, 2025

Magnetic Regulation in Negatively Charged Hydrogen Vacancy Defect Nanodiamond Driven by Intrinsic H-Mobility and External Electric Field.

Magnetic Regulation in Negatively Charged Hydrogen Vacancy Defect Nanodiamond Driven by Intrinsic H-Mobility and External Electric Field.

Journal: Inorganic chemistry

Published: May 11, 2025

Geometrically and Micromechanically Optimized Sprayable Short Fibers for Precision Pesticide Delivery.

Geometrically and Micromechanically Optimized Sprayable Short Fibers for Precision Pesticide Delivery.

Journal: Small (Weinheim an der Bergstrasse, Germany)

Published: April 12, 2025

Electric field manipulated magnetic spin coupling properties in lithium-trapped nitrogen-vacancy nanodiamonds.

Electric field manipulated magnetic spin coupling properties in lithium-trapped nitrogen-vacancy nanodiamonds.

Journal: Physical chemistry chemical physics : PCCP

Published: March 06, 2025

Showing 1-12 of 52

Last Updated: 09/26/2026