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2024
Deciphering the Microdroplet Acceleration Factors of Aza-Michael Addition Reactions
Song, Z., Zhu, C., Gong, K., Wang, R., Zhang, J., Zhao, S., Li, Z., Zhang, X. & Xie, J., 17 4月 2024, 在: Journal of the American Chemical Society. 146, 15, 页码 10963-10972 10 页码科研成果: 期刊稿件 › 文章 › 同行评审
12 引用 (Scopus) -
Multiple noncovalent conformational locks combined with π-bridge engineering as high-performance Y-series acceptors for organic photovoltaics
投稿的翻译标题: 多重非共价构象锁与π桥工程相结合用于开发Y系列 受体Yang, J., Li, Q. & Li, Z., 5月 2024, 在: Science China Materials. 67, 5, 页码 1612-1620 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
开放访问1 引用 (Scopus) -
Two Key Descriptors for Designing Second Near-Infrared Dyes and Experimental Validation
Zeng, Y., Qu, J., Wu, G., Zhao, Y., Hao, J., Dong, Y., Li, Z., Shi, J., Francisco, J. S. & Zheng, X., 10 4月 2024, 在: Journal of the American Chemical Society. 146, 14, 页码 9888-9896 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
12 引用 (Scopus) -
2023
Efficient regulation of active layer morphology and interfacial charge-transfer process by porphyrin-based additive in organic solar cells
Yang, J., Li, Q. S. & Li, Z. S., 20 2月 2023, 在: Colloids and Surfaces A: Physicochemical and Engineering Aspects. 659, 130818.科研成果: 期刊稿件 › 文章 › 同行评审
3 引用 (Scopus) -
Encapsulate lithium sulfide cathodes with carbon-doped MoS2 for fast kinetics in lithium-sulfur batteries, a theoretical study
Zhao, B., Ren, Z., Li, Z., Tan, G. & Xie, J., 1 1月 2023, 在: Acta Materialia. 242, 118441.科研成果: 期刊稿件 › 文章 › 同行评审
12 引用 (Scopus) -
Incorporation of a Boron–Nitrogen Covalent Bond Improves the Charge-Transport and Charge-Transfer Characteristics of Organoboron Small-Molecule Acceptors for Organic Solar Cells
Yang, J., Ding, W. L., Li, Q. S. & Li, Z. S., 1月 2023, 在: Molecules. 28, 2, 811.科研成果: 期刊稿件 › 文章 › 同行评审
开放访问13 引用 (Scopus) -
In-Plane Porous Graphene: A Promising Anode Material with High Ion Mobility and Energy Storage for Rubidium-Ion Batteries
Lu, B., Ru, N., Duan, J., Li, Z. & Qu, J., 20 6月 2023, 在: ACS Omega. 8, 24, 页码 21842-21852 11 页码科研成果: 期刊稿件 › 文章 › 同行评审
开放访问4 引用 (Scopus) -
Structural design of a new XLPE Insulation material without cross-linking by-products and theoretical study on the reaction mechanism: An alternative to peroxide crosslinking
Han, W., Zhang, H., Du, X., Shang, Y., Du, Y., Yang, H., Wang, X., Chen, Q. & Li, Z., 8月 2023, 在: Materials Today Communications. 36, 106483.科研成果: 期刊稿件 › 文章 › 同行评审
1 引用 (Scopus) -
Theoretical insights into the rational design of small organic phototheranostic agents for promoting image-guided cancer surgery
Zhang, J., Yang, J., Zeng, Y., Li, Z. S. & Zheng, X., 6 1月 2023, 在: Materials Chemistry Frontiers. 7, 3, 页码 545-553 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
2 引用 (Scopus) -
Theoretical study on the reaction mechanism of a new XLPE insulation material without cross-linking byproducts: An alternative to peroxide cross-linking
Zhang, H., Han, W., Du, X., Shang, Y., Du, Y., Dong, S., Yang, H., Wang, X., Chen, Q. & Li, Z., 5 9月 2023, 在: International Journal of Quantum Chemistry. 123, 17, e27145.科研成果: 期刊稿件 › 文章 › 同行评审
1 引用 (Scopus) -
2022
Atomistic Mechanism of Surface-Defect Passivation: Toward Stable and Efficient Perovskite Solar Cells
Zhang, W., Li, Q. S. & Li, Z. S., 28 7月 2022, 在: Journal of Physical Chemistry Letters. 13, 29, 页码 6686-6693 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
19 引用 (Scopus) -
A π-extended triphenylamine based dopant-free hole-transporting material for perovskite solar cells: Via heteroatom substitution
Hao, M., Tan, D., Chi, W. & Li, Z. S., 2月 2022, 在: Physical Chemistry Chemical Physics. 24, 7, 页码 4635-4643 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
11 引用 (Scopus) -
Boron-based non-fullerene small molecule acceptors via nitrogen substitution: a theoretical study
Yang, J., Wu, X., Li, Q. S. & Li, Z. S., 21 2月 2022, 在: Materials Advances. 3, 7, 页码 3229-3237 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
开放访问4 引用 (Scopus) -
Defects on Li2S@graphene cathode improves the performance of lithium-sulfur battery, A theoretical study
Zhao, B., Ren, Z., Tan, G., Li, Z. & Xie, J., 3月 2022, 在: Acta Materialia. 226, 117632.科研成果: 期刊稿件 › 文章 › 同行评审
17 引用 (Scopus) -
Molecular Engineering in Perovskite Solar Cells: A Computational Study on 2-Mercaptopyridine Derivatives as Surface Passivators against Water
Zhang, W., Li, Q. S. & Li, Z. S., 22 2月 2022, 在: Advanced Materials Interfaces. 9, 6, 2101881.科研成果: 期刊稿件 › 文章 › 同行评审
16 引用 (Scopus) -
Monolayer H-MoS2 with high ion mobility as a promising anode for rubidium (cesium)-ion batteries
Lu, B., Liu, X., Qu, J. & Li, Z., 21 7月 2022, 在: Nanoscale Advances. 4, 18, 页码 3756-3763 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
开放访问4 引用 (Scopus) -
Theoretical insights into photo-induced isomerization mechanisms of phenylsulfinyl radical PhSO˙†
Liu, M. K., Li, J., Li, Q. S. & Li, Z. S., 15 2月 2022, 在: Physical Chemistry Chemical Physics. 24, 10, 页码 6266-6273 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
3 引用 (Scopus) -
Theoretical Study of Non-Fullerene Acceptors Using End-Capped Groups with Different Electron-Withdrawing Abilities toward Efficient Organic Solar Cells
Yang, J., Ding, W. L., Li, Q. S. & Li, Z. S., 27 1月 2022, 在: Journal of Physical Chemistry Letters. 13, 3, 页码 916-922 7 页码科研成果: 期刊稿件 › 文章 › 同行评审
28 引用 (Scopus) -
Theoretical study on the cross-linking reaction mechanism of cellulose nanofibrils initiated by fluorine
Zhang, H., Du, X., Deng, C., Shang, Y., Yang, H., Chen, Q. & Li, Z., 11月 2022, 在: Journal of Molecular Graphics and Modelling. 116, 108266.科研成果: 期刊稿件 › 文章 › 同行评审
6 引用 (Scopus) -
2021
Achieving Highly Efficient Carbon Dioxide Electrolysis by in Situ Construction of the Heterostructure
Yang, X., Sun, W., Ma, M., Xu, C., Ren, R., Qiao, J., Wang, Z., Li, Z., Zhen, S. & Sun, K., 5 5月 2021, 在: ACS Applied Materials and Interfaces. 13, 17, 页码 20060-20069 10 页码科研成果: 期刊稿件 › 文章 › 同行评审
55 引用 (Scopus) -
Binding properties of cucurbit[7]uril to neutral and protonated amino acids: A theoretical study
Ma, F., Zheng, X., Xie, J. & Li, Z., 5 3月 2021, 在: International Journal of Quantum Chemistry. 121, 5, e26491.科研成果: 期刊稿件 › 文章 › 同行评审
6 引用 (Scopus) -
Boron-nitrogen substituted planar cores: Designing dopant-free hole-Transporting materials for efficient perovskite solar cells
Hao, M., Chi, W. & Li, Z., 21 2月 2021, 在: Nanoscale. 13, 7, 页码 4241-4248 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
20 引用 (Scopus) -
Doping effects on catechol functionalized anatase TiO2(101) surface for dye-sensitized solar cells
Luo, J. H., Mo, Y. F., Li, Z. S. & Du, F. Y., 1月 2021, 在: Materials Research Express. 8, 1, 015906.科研成果: 期刊稿件 › 文章 › 同行评审
开放访问3 引用 (Scopus) -
Host-guest interaction-induced emission enhancement of amphiphilic AIEgens: A computational study
Yang, J., Peng, Q., Xue, R., Li, Z. & Zheng, X., 21 2月 2021, 在: Materials Chemistry Frontiers. 5, 4, 页码 1806-1816 11 页码科研成果: 期刊稿件 › 文章 › 同行评审
20 引用 (Scopus) -
Sequence-dependent nanomolar binding of tripeptides containing N-terminal phenylalanine by Cucurbit[7]uril: A theoretical study
Ma, F., Zheng, X., Xie, L. & Li, Z., 15 4月 2021, 在: Journal of Molecular Liquids. 328, 115479.科研成果: 期刊稿件 › 文章 › 同行评审
9 引用 (Scopus) -
Sequence-selective recognition of cationic amphipathic tripeptides with similar structures in aqueous solutions by cucurbit[7]uril
Ma, F., Zheng, X. & Li, Z., 22 6月 2021, 在: Physical Chemistry Chemical Physics. 23, 24, 页码 13724-13733 10 页码科研成果: 期刊稿件 › 文章 › 同行评审
6 引用 (Scopus) -
Theoretical design of asymmetric A-D1A′D2-A type non-fullerene acceptors for organic solar cells
Yang, J., Li, Q. S. & Li, Z. S., 7 6月 2021, 在: Physical Chemistry Chemical Physics. 23, 21, 页码 12321-12328 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
24 引用 (Scopus) -
Theoretical study on the grafting reaction of maleimide containing 2-hydroxy-benzophenone onto polyethylene
Zhang, H., Deng, C., Du, X., Shang, Y., Zhao, H., Wang, X., Han, B. & Li, Z., 9月 2021, 在: Journal of Molecular Modeling. 27, 9, 259.科研成果: 期刊稿件 › 文章 › 同行评审
开放访问1 引用 (Scopus) -
Theoretical study on thienothiophene core hole-transporting materials in perovskite solar cells: S atom position effect
Gao, Z., Hao, M. & Li, Z., 2月 2021, 在: Chemical Physics Letters. 764, 138264.科研成果: 期刊稿件 › 文章 › 同行评审
22 引用 (Scopus) -
Understanding the surface passivation effects of Lewis base in perovskite solar cells
Zhang, W., Li, Q. S. & Li, Z. S., 15 10月 2021, 在: Applied Surface Science. 563, 150267.科研成果: 期刊稿件 › 文章 › 同行评审
31 引用 (Scopus) -
2020
A molecular-scale study on the role of methanesulfinic acid in marine new particle formation
Ning, A., Zhang, H., Zhang, X., Li, Z., Zhang, Y., Xu, Y. & Ge, M., 15 4月 2020, 在: Atmospheric Environment. 227, 117378.科研成果: 期刊稿件 › 文章 › 同行评审
22 引用 (Scopus) -
A promising photocatalyst for water-splitting reactions with a stable sandwiched P4O2/black phosphorus heterostructure and high solar-to-hydrogen efficiency
Lu, B., Zheng, X. & Li, Z., 28 3月 2020, 在: Nanoscale. 12, 12, 页码 6617-6623 7 页码科研成果: 期刊稿件 › 文章 › 同行评审
22 引用 (Scopus) -
Consolidating Lithiothermic-Ready Transition Metals for Li2S-Based Cathodes
Xing, Z., Tan, G., Yuan, Y., Wang, B., Ma, L., Xie, J., Li, Z., Wu, T., Ren, Y., Shahbazian-Yassar, R., Lu, J., Ji, X. & Chen, Z., 1 8月 2020, 在: Advanced Materials. 32, 31, 2002403.科研成果: 期刊稿件 › 文章 › 同行评审
开放访问74 引用 (Scopus) -
Designing Hole Transport Materials with High Hole Mobility and Outstanding Interface Properties for Perovskite Solar Cells
Jiang, R., Zhu, R. & Li, Z. S., 18 8月 2020, 在: ChemPhysChem. 21, 16, 页码 1866-1872 7 页码科研成果: 期刊稿件 › 文章 › 同行评审
4 引用 (Scopus) -
End-capped group manipulation of indacenodithienothiophene-based non-fullerene small molecule acceptors for efficient organic solar cells
Yang, J., Li, Q. S. & Li, Z. S., 14 9月 2020, 在: Nanoscale. 12, 34, 页码 17795-17804 10 页码科研成果: 期刊稿件 › 文章 › 同行评审
23 引用 (Scopus) -
Molecular Engineering of Hexaazatriphenylene Derivatives toward More Efficient Electron-Transporting Materials for Inverted Perovskite Solar Cells
Zhu, R., Li, Q. S. & Li, Z. S., 26 8月 2020, 在: ACS applied materials & interfaces. 12, 34, 页码 38222-38231 10 页码科研成果: 期刊稿件 › 文章 › 同行评审
20 引用 (Scopus) -
Molecular Origins of Photoinduced Backward Intramolecular Charge Transfer
Hao, M., Chi, W., Wang, C., Xu, Z., Li, Z. & Liu, X., 6 8月 2020, 在: Journal of Physical Chemistry C. 124, 31, 页码 16820-16826 7 页码科研成果: 期刊稿件 › 文章 › 同行评审
25 引用 (Scopus) -
Nucleation mechanisms of iodic acid in clean and polluted coastal regions
Rong, H., Liu, J., Zhang, Y., Du, L., Zhang, X. & Li, Z., 8月 2020, 在: Chemosphere. 253, 126743.科研成果: 期刊稿件 › 文章 › 同行评审
29 引用 (Scopus) -
Positional Effect of the Triphenylamine Group on the Optical and Charge-Transfer Properties of Thiophene-Based Hole-Transporting Materials
Hao, M., Chi, W. & Li, Z., 17 1月 2020, 在: Chemistry - An Asian Journal. 15, 2, 页码 287-293 7 页码科研成果: 期刊稿件 › 文章 › 同行评审
17 引用 (Scopus) -
Theoretical study on the hydrogen addition reactions to bismaleimide in the ultra-violet radiation cross-linking process of polyethylene
Zhang, H., Deng, C., Shang, Y., Zhao, H., Wang, X., Han, B. & Li, Z., 11月 2020, 在: Journal of Molecular Graphics and Modelling. 100, 107679.科研成果: 期刊稿件 › 文章 › 同行评审
11 引用 (Scopus) -
Theoretical study on the photochemistry of furoylazides: Curtius rearrangement and subsequent reactions
Li, J., Liu, M. K., Li, Q. S. & Li, Z. S., 28 12月 2020, 在: Physical Chemistry Chemical Physics. 22, 48, 页码 28317-28324 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
9 引用 (Scopus) -
Two-Dimensional Lateral Heterostructures of Triphosphides: AlP3-GaP3as a Promising Photocatalyst for Water Splitting
Lu, B., Zheng, X. & Li, Z., 2 12月 2020, 在: ACS applied materials & interfaces. 12, 48, 页码 53731-53738 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
31 引用 (Scopus) -
Understanding the effects of the co-sensitizing ratio on the surface potential, electron injection efficiency, and Förster resonance energy transfer
Yang, J., Peng, X. L., Sun, Z. Z., Feng, S., Ding, W. L., He, H. Y. & Li, Z. S., 14 3月 2020, 在: Physical Chemistry Chemical Physics. 22, 10, 页码 5568-5576 9 页码科研成果: 期刊稿件 › 文章 › 同行评审
5 引用 (Scopus) -
2019
A peri-Xanthenoxanthene Centered Columnar-Stacking Organic Semiconductor for Efficient, Photothermally Stable Perovskite Solar Cells
Xu, N., Li, Y., Wu, R., Zhu, R., Zhang, J., Zakeeruddin, S. M., Li, H., Li, Z. S., Grätzel, M. & Wang, P., 18 1月 2019, 在: Chemistry - A European Journal. 25, 4, 页码 945-948 4 页码科研成果: 期刊稿件 › 文章 › 同行评审
21 引用 (Scopus) -
Effect of SiC nano-size fillers on the aging resistance of XLPE insulation: A first-principles study
Zhang, H., Liu, Y., Du, X., Wang, X., Zheng, X. & Li, Z., 12月 2019, 在: Journal of Molecular Graphics and Modelling. 93, 107438.科研成果: 期刊稿件 › 文章 › 同行评审
8 引用 (Scopus) -
End-capped group manipulation of fluorene-based small molecule acceptors for efficient organic solar cells
Wang, Y. L., Li, Q. S. & Li, Z. S., 1月 2019, 在: Computational Materials Science. 156, 页码 252-259 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
31 引用 (Scopus) -
Few-Layer P 4 O 2: A Promising Photocatalyst for Water Splitting
Lu, B., Zheng, X. & Li, Z., 13 3月 2019, 在: ACS applied materials & interfaces. 11, 10, 页码 10163-10170 8 页码科研成果: 期刊稿件 › 文章 › 同行评审
31 引用 (Scopus) -
Fluorination of benzene with disubstituted N-fluoropyridinium salts in acetonitrile solution: a DFT study
Du, X., Zhang, H., Yao, Y., Lu, Y., Wang, A., Wang, Y. & Li, Z., 1 2月 2019, 在: Theoretical Chemistry Accounts. 138, 2, 28.科研成果: 期刊稿件 › 文章 › 同行评审
3 引用 (Scopus) -
Further discussion on the reaction behaviour of triallyl isocyanurate in the UV radiation cross-linking process of polyethylene: A theoretical study
Zhang, H., Shang, Y., Zhao, H., Wang, X., Han, B. & Li, Z., 2019, 在: Royal Society Open Science. 6, 9, 182196.科研成果: 期刊稿件 › 文章 › 同行评审
开放访问4 引用 (Scopus) -
Influence of Sn/Ge Cation Exchange on Vacancy-Ordered Double Perovskite Cs2Sn(1−x)GexI6: A First-Principles Theoretical Study
Ma, X. X. & Li, Z. S., 3月 2019, 在: Physica Status Solidi (B): Basic Research. 256, 3, 1800427.科研成果: 期刊稿件 › 文章 › 同行评审
26 引用 (Scopus)