Zhang L - Search Results

1

Phase Diagram of a Deep Potential Water Model.

Zhang L, Wang H, Car R, E W. Zhang L, et al. Phys Rev Lett. 2021 Jun 11;126(23):236001. doi: 10.1103/PhysRevLett.126.236001. Phys Rev Lett. 2021. PMID: 34170175

2

Reinforced dynamics for enhanced sampling in large atomic and molecular systems.

Zhang L, Wang H, E W. Zhang L, et al. J Chem Phys. 2018 Mar 28;148(12):124113. doi: 10.1063/1.5019675. J Chem Phys. 2018. PMID: 29604808

3

Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics.

Zhang L, Han J, Wang H, Car R, E W. Zhang L, et al. Phys Rev Lett. 2018 Apr 6;120(14):143001. doi: 10.1103/PhysRevLett.120.143001. Phys Rev Lett. 2018. PMID: 29694129

4

DeePCG: Constructing coarse-grained models via deep neural networks.

Zhang L, Han J, Wang H, Car R, E W. Zhang L, et al. J Chem Phys. 2018 Jul 21;149(3):034101. doi: 10.1063/1.5027645. J Chem Phys. 2018. PMID: 30037247

5

Adaptive coupling of a deep neural network potential to a classical force field.

Zhang L, Wang H, E W. Zhang L, et al. J Chem Phys. 2018 Oct 21;149(15):154107. doi: 10.1063/1.5042714. J Chem Phys. 2018. PMID: 30342462

6

Raman spectrum and polarizability of liquid water from deep neural networks.

Sommers GM , Calegari Andrade MF , Zhang L , Wang H , Car R . Sommers GM , et al. Among authors: zhang l. Phys Chem Chem Phys. 2020 May 21;22(19):10592-10602. doi: 10.1039/d0cp01893g. Epub 2020 May 7. Phys Chem Chem Phys. 2020. PMID: 32377657

7

Ground State Energy Functional with Hartree-Fock Efficiency and Chemical Accuracy.

Chen Y, Zhang L, Wang H, E W. Chen Y, et al. Among authors: zhang l. J Phys Chem A. 2020 Sep 3;124(35):7155-7165. doi: 10.1021/acs.jpca.0c03886. Epub 2020 Aug 19. J Phys Chem A. 2020. PMID: 32786985

8

Signatures of a liquid-liquid transition in an ab initio deep neural network model for water.

Gartner TE 3rd, Zhang L, Piaggi PM, Car R, Panagiotopoulos AZ, Debenedetti PG. Gartner TE 3rd, et al. Among authors: zhang l. Proc Natl Acad Sci U S A. 2020 Oct 20;117(42):26040-26046. doi: 10.1073/pnas.2015440117. Epub 2020 Oct 2. Proc Natl Acad Sci U S A. 2020. PMID: 33008883 Free PMC article.

9

DeePKS: A Comprehensive Data-Driven Approach toward Chemically Accurate Density Functional Theory.

Chen Y, Zhang L, Wang H, E W. Chen Y, et al. Among authors: zhang l. J Chem Theory Comput. 2021 Jan 12;17(1):170-181. doi: 10.1021/acs.jctc.0c00872. Epub 2020 Dec 9. J Chem Theory Comput. 2021. PMID: 33296197

10

Crystal Structure Prediction of Binary Alloys via Deep Potential.

Wang H, Zhang Y, Zhang L, Wang H. Wang H, et al. Among authors: zhang l, zhang y. Front Chem. 2020 Nov 26;8:589795. doi: 10.3389/fchem.2020.589795. eCollection 2020. Front Chem. 2020. PMID: 33330377 Free PMC article.

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