Shuhua Li

78PUBLICATIONS
61CO-AUTHORS
Organometallic chemistryCondensed matter modelling and density functional theoryTheoretical quantum chemistryChemical and thermal processes in energy and combustionFormal methods for software
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Publications (78)

|Jul 24, 2026
One-Pot Conversion of Acridines Into Phototherapeutic Near-Infrared Spirocyanines.

|Jul 03, 2026
Correction to "Equation-of-Motion Block-Correlated Coupled Cluster Method for Excited Electronic States of Strongly Correlated Systems".

|Jul 01, 2026
Correction to "Cluster-in-Molecule Local Correlation Method with an Accurate Distant Pair Correction for Large Systems".

|May 05, 2026
Double-Hybrid Density Functional Theory within the Cluster-in-Molecule Local Correlation Framework for Large Molecular Systems.

|Apr 15, 2026
Block-Correlated Coupled Cluster Theory with up to Five-Pair Correlation for Accurate Static Correlation of High-Spin Strongly Correlated Systems.

|Apr 09, 2026
Computation-Driven Experimental Discovery of Reactivity Space of Organoboron Compounds.

Guoqiang Wang, Shuhua Li

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Frequent Collaborators

28 joint publications

Wei Li

11 joint publications

Guoqiang Wang

10 joint publications

Jing Ma

9 joint publications

Zhigang Ni