Wang J - Search Results

1

Step-Assisted On-Surface Synthesis of Graphene Nanoribbons Embedded with Periodic Divacancies.

Yin R, Wang J, Qiu ZL, Meng J, Xu H, Wang Z, Liang Y, Zhao XJ, Ma C, Tan YZ, Li Q, Wang B. Yin R, et al. Among authors: wang j, wang z, wang b. J Am Chem Soc. 2022 Aug 17;144(32):14798-14808. doi: 10.1021/jacs.2c05570. Epub 2022 Aug 4. J Am Chem Soc. 2022. PMID: 35926228

2

Spin-Transport Tuning of Individual Magnetic Mn-Salophen Molecule via Chemical Adsorption.

Li F, Huang J, Wang J, Li Q. Li F, et al. Among authors: wang j. Molecules. 2019 May 6;24(9):1747. doi: 10.3390/molecules24091747. Molecules. 2019. PMID: 31064070 Free PMC article.

3

C₇N₆/Sc₂CCl₂ Weak van der Waals Heterostructure: A Promising Visible-Light-Driven Z-Scheme Water Splitting Photocatalyst with Interface Ultrafast Carrier Recombination.

Meng J, Wang J, Wang J, Li Q, Yang J. Meng J, et al. Among authors: wang j. J Phys Chem Lett. 2022 Feb 17;13(6):1473-1479. doi: 10.1021/acs.jpclett.1c04194. Epub 2022 Feb 7. J Phys Chem Lett. 2022. PMID: 35129359

4

Self-Limited Embedding Alternating 585-Ringed Divacancies and Metal Atoms into Graphene Nanoribbons.

Wang Z, Yin R, Meng J, Wang J, Liang Y, Ma C, Tan S, Li Q, Yang J, Wang B. Wang Z, et al. Among authors: wang j, wang b. J Am Chem Soc. 2023 Apr 4. doi: 10.1021/jacs.3c00111. Online ahead of print. J Am Chem Soc. 2023. PMID: 37014727

5

Accelerated Computation of Free Energy Profile at Ab Initio Quantum Mechanical/Molecular Mechanics Accuracy via a Semiempirical Reference Potential. 4. Adaptive QM/MM.

Wang JN, Liu W, Li P, Mo Y, Hu W, Zheng J, Pan X, Shao Y, Mei Y. Wang JN, et al. J Chem Theory Comput. 2021 Mar 9;17(3):1318-1325. doi: 10.1021/acs.jctc.0c01149. Epub 2021 Feb 16. J Chem Theory Comput. 2021. PMID: 33593057 Free PMC article.

6

Potent inhibitors targeting cyclin-dependent kinase 9 discovered via virtual high-throughput screening and absolute binding free energy calculations.

Wang S, Liu F, Li P, Wang JN, Mo Y, Lin B, Mei Y. Wang S, et al. Phys Chem Chem Phys. 2024 Feb 7;26(6):5377-5386. doi: 10.1039/d3cp05582e. Phys Chem Chem Phys. 2024. PMID: 38269624

7

Accelerated Computation of Free Energy Profile at Ab Initio Quantum Mechanical/Molecular Mechanics Accuracy via a Semiempirical Reference Potential. 3. Gaussian Smoothing on Density-of-States.

Hu W, Li P, Wang JN, Xue Y, Mo Y, Zheng J, Pan X, Shao Y, Mei Y. Hu W, et al. Among authors: wang jn. J Chem Theory Comput. 2020 Nov 10;16(11):6814-6822. doi: 10.1021/acs.jctc.0c00794. Epub 2020 Oct 6. J Chem Theory Comput. 2020. PMID: 32975951 Free PMC article.

8

Trapping integrated molecular devices via local transport circulation.

Xiong YC, Wang JN, Wang PC, Zhou Y, Ma YN, Zhou WH, Tong R. Xiong YC, et al. Phys Chem Chem Phys. 2022 Mar 2;24(9):5522-5528. doi: 10.1039/d1cp04813a. Phys Chem Chem Phys. 2022. PMID: 35171974

9

Synergistic Enhancement of Carrier Migration by SnO₂/ZnO@GO Heterojunction for Rapid Degradation of RhB.

Chen P, Li J, Wang J, Deng L. Chen P, et al. Among authors: wang j. Molecules. 2024 Feb 14;29(4):854. doi: 10.3390/molecules29040854. Molecules. 2024. PMID: 38398606 Free PMC article.

10

Affordable Ab Initio Path Integral for Thermodynamic Properties via Molecular Dynamics Simulations Using Semiempirical Reference Potential.

Xue Y, Wang JN, Hu W, Zheng J, Li Y, Pan X, Mo Y, Shao Y, Wang L, Mei Y. Xue Y, et al. Among authors: wang l, wang jn. J Phys Chem A. 2021 Dec 23;125(50):10677-10685. doi: 10.1021/acs.jpca.1c07727. Epub 2021 Dec 12. J Phys Chem A. 2021. PMID: 34894680 Free PMC article.

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