Zhang J - Search Results

1

Multistate Energy Decomposition Analysis of Molecular Excited States.

Hettich CP, Zhang X, Kemper D, Zhao R, Zhou S, Lu Y, Gao J, Zhang J, Liu M. Hettich CP, et al. Among authors: zhang j, zhang x. JACS Au. 2023 Jun 24;3(7):1800-1819. doi: 10.1021/jacsau.3c00186. eCollection 2023 Jul 24. JACS Au. 2023. PMID: 37502166 Free PMC article. Review.

2

Minimal Active Space: NOSCF and NOSI in Multistate Density Functional Theory.

Lu Y, Zhao R, Zhang J, Liu M, Gao J. Lu Y, et al. Among authors: zhang j. J Chem Theory Comput. 2022 Nov 8;18(11):6407-6420. doi: 10.1021/acs.jctc.2c00908. Epub 2022 Oct 26. J Chem Theory Comput. 2022. PMID: 36287915 Review.

3

Target State Optimized Density Functional Theory for Electronic Excited and Diabatic States.

Zhang J, Tang Z, Zhang X, Zhu H, Zhao R, Lu Y, Gao J. Zhang J, et al. Among authors: zhang x. J Chem Theory Comput. 2023 Mar 28;19(6):1777-1789. doi: 10.1021/acs.jctc.2c01317. Epub 2023 Mar 14. J Chem Theory Comput. 2023. PMID: 36917687

4

Excimer Energies.

Zhao R, Hettich C, Zhang J, Liu M, Gao J. Zhao R, et al. Among authors: zhang j. J Phys Chem Lett. 2023 Mar 30;14(12):2917-2926. doi: 10.1021/acs.jpclett.3c00545. Epub 2023 Mar 17. J Phys Chem Lett. 2023. PMID: 36929896

5

Cryo-EM structures of LHCII in photo-active and photo-protecting states reveal allosteric regulation of light harvesting and excess energy dissipation.

Ruan M, Li H, Zhang Y, Zhao R, Zhang J, Wang Y, Gao J, Wang Z, Wang Y, Sun D, Ding W, Weng Y. Ruan M, et al. Among authors: zhang j, zhang y. Nat Plants. 2023 Sep;9(9):1547-1557. doi: 10.1038/s41477-023-01500-2. Epub 2023 Aug 31. Nat Plants. 2023. PMID: 37653340

6

Leveling the Mountain Range of Excited-State Benchmarking through Multistate Density Functional Theory.

Zhu H, Zhao R, Lu Y, Liu M, Zhang J, Gao J. Zhu H, et al. Among authors: zhang j. J Phys Chem A. 2023 Oct 12;127(40):8473-8485. doi: 10.1021/acs.jpca.3c04799. Epub 2023 Sep 28. J Phys Chem A. 2023. PMID: 37768927

7

Graphene Oxide as a Pb(II) Separation Medium: Has Part of the Story Been Overlooked?

Nguyen MT, Zhang J, Prabhakaran V, Tan S, Baxter ET, Shutthanandan V, Johnson GE, Rousseau R, Glezakou VA. Nguyen MT, et al. Among authors: zhang j. JACS Au. 2021 Apr 5;1(6):766-776. doi: 10.1021/jacsau.0c00075. eCollection 2021 Jun 28. JACS Au. 2021. PMID: 34467331 Free PMC article.

8

Enhanced sampling in molecular dynamics.

Yang YI, Shao Q, Zhang J, Yang L, Gao YQ. Yang YI, et al. Among authors: zhang j. J Chem Phys. 2019 Aug 21;151(7):070902. doi: 10.1063/1.5109531. J Chem Phys. 2019. PMID: 31438687

9

Deep Representation Learning for Complex Free-Energy Landscapes.

Zhang J, Lei YK, Che X, Zhang Z, Yang YI, Gao YQ. Zhang J, et al. Among authors: zhang z. J Phys Chem Lett. 2019 Sep 19;10(18):5571-5576. doi: 10.1021/acs.jpclett.9b02012. Epub 2019 Sep 5. J Phys Chem Lett. 2019. PMID: 31476868

10

Artificial Intelligence Enhanced Molecular Simulations.

Zhang J, Chen D, Xia Y, Huang YP, Lin X, Han X, Ni N, Wang Z, Yu F, Yang L, Yang YI, Gao YQ. Zhang J, et al. J Chem Theory Comput. 2023 Jul 25;19(14):4338-4350. doi: 10.1021/acs.jctc.3c00214. Epub 2023 Jun 26. J Chem Theory Comput. 2023. PMID: 37358079 Review.

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