Shuhua Li
Affiliations: | Chemistry | Nanjing University, Nanjing Shi, Jiangsu Sheng, China |
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Sign in to add trainee| Hao Dong | grad student | ||
| Yang Guo | grad student | ||
| Wei Li | grad student | Nanjing University | |
| Zhigang Ni | grad student | Nanjing University | |
| Jingxiang Zou | grad student | Nanjing University | |
| Kang Liao | grad student | 2017-2022 | Nanjing University |
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Publications
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| Ren X, Zou J, Zhang H, et al. (2024) Block-Correlated Coupled Cluster Theory with up to Four-Pair Correlation for Accurate Static Correlation of Strongly Correlated Systems. The Journal of Physical Chemistry Letters. 693-700 |
| Li W, Wang Y, Ni Z, et al. (2023) Cluster-in-Molecule Local Correlation Method for Dispersion Interactions in Large Systems and Periodic Systems. Accounts of Chemical Research |
| Wang Y, Guo Y, Neese F, et al. (2023) Cluster-in-Molecule Approach with Explicitly Correlated Methods for Large Molecules. Journal of Chemical Theory and Computation |
| Gao L, Liang X, He L, et al. (2023) Base-mediated C-B bond activation of benzylic boronate for the rapid construction of β-silyl/boryl functionalized 1,1-diarylalkanes from aromatic alkenes. Chemical Science. 14: 11881-11889 |
| Zhang H, Zou J, Ren X, et al. (2023) Equation-of-Motion Block-Correlated Coupled Cluster Method for Excited Electronic States of Strongly Correlated Systems. The Journal of Physical Chemistry Letters. 14: 6792-6799 |
| Huo J, Chen J, Liu P, et al. (2023) Microscopic Mechanism of Proton Transfer in Pure Water under Ambient Conditions. Journal of Chemical Theory and Computation |
| Hong B, Fang T, Li W, et al. (2023) Predicting the structures and vibrational spectra of molecular crystals containing large molecules with the generalized energy-based fragmentation approach. The Journal of Chemical Physics. 158: 044117 |
| Xiong Y, Li B, Gu Y, et al. (2022) Photocatalytic nitrogen fixation under an ambient atmosphere using a porous coordination polymer with bridging dinitrogen anions. Nature Chemistry |
| Du J, Liao K, Ma J, et al. (2022) Generalized Energy-Based Fragmentation Approach for the Electronic Emission Spectra of Large Systems. Journal of Chemical Theory and Computation |
| Zhu Q, Zhang S, Ma J, et al. (2022) Catalytic Mechanisms of Transfer Hydrogenation of Azobenzene with Ammonia Borane by Pincer Bismuth Complex: Crucial Role of C=N Functional Group on the Pincer Ligand. Chemistry, An Asian Journal |