DOI: 10.1103/physrevlett.120.143001. Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics

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

10.1103/physrevlett.120.143001

Crossref journal-article

American Physical Society (APS)

Physical Review Letters (16)

Bibliography

Zhang, L., Han, J., Wang, H., Car, R., & E, W. (2018). Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics. Physical Review Letters, 120(14).

Authors 5

Linfeng Zhang (first)
Jiequn Han (additional)
Han Wang (additional)
Roberto Car (additional)
Weinan E (additional)

References 39 Referenced 1,539

10.1103/PhysRevLett.55.2471
10.1017/CBO9780511609633 / Ab Initio Molecular Dynamics: Basic Theory and Advanced Methods by D. Marx (2009)
10.1103/PhysRev.140.A1133
10.1002/jcc.21367
10.1021/ja9621760
10.1002/jcc.20035
10.1103/PhysRevB.31.5262
10.1103/PhysRevB.29.6443
10.1088/0953-8984/14/4/312
10.1021/jp004368u
10.1016/j.jcp.2014.12.018
10.1038/s41524-017-0042-y
10.1103/PhysRevLett.98.146401
10.1063/1.4966192
10.1073/pnas.1602375113
10.1103/PhysRevLett.104.136403
10.1103/PhysRevLett.108.058301
10.1038/ncomms13890
10.1126/sciadv.1603015
10.1039/C6SC05720A
10.1016/j.cpc.2018.03.016
10.4208/cicp.OA-2017-0213 / Commun. Comput. Phys. by J. Han (2018)
{'volume-title': 'Deep Learning', 'year': '2016', 'author': 'I. Goodfellow', 'key': 'PhysRevLett.120.143001Cc25R1'} / Deep Learning by I. Goodfellow (2016)
{'volume-title': 'Advances in Neural Information Processing Systems', 'year': '2007', 'author': 'Y. Bengio', 'key': 'PhysRevLett.120.143001Cc27R1'} / Advances in Neural Information Processing Systems by Y. Bengio (2007)
{'volume-title': 'Advances in Neural Information Processing Systems', 'year': '2012', 'author': 'A. Krizhevsky', 'key': 'PhysRevLett.120.143001Cc28R1'} / Advances in Neural Information Processing Systems by A. Krizhevsky (2012)
10.1063/1.478522
10.1103/PhysRevLett.102.073005
10.1103/PhysRevLett.77.3865
10.1016/j.cpc.2013.10.027
10.1063/1.2977970
10.1063/1.3556661
10.1063/1.463940
10.1103/PhysRevLett.45.1196
{'volume-title': 'Proceedings of the 32nd International Conference on Machine Learning', 'year': '2015', 'author': 'S. Ioffe', 'key': 'PhysRevLett.120.143001Cc40R1'} / Proceedings of the 32nd International Conference on Machine Learning by S. Ioffe (2015)
10.1063/1.445869
10.1093/bioinformatics/btt055
10.1088/1361-648X/aa8f79
10.1063/1.464480
10.1126/science.231.4738.555

Dates

Type	When
Created	7 years, 4 months ago (April 4, 2018, 10:02 a.m.)
Deposited	1 month, 2 weeks ago (July 3, 2025, 8:30 a.m.)
Indexed	49 minutes ago (Aug. 21, 2025, 2:28 p.m.)
Issued	7 years, 4 months ago (April 4, 2018)
Published	7 years, 4 months ago (April 4, 2018)
Published Online	7 years, 4 months ago (April 4, 2018)

Funders 5

National Natural Science Foundation of China 10.13039/501100001809
Region: Asia
gov (National government)
Labels11
1. Chinese National Science Foundation
2. Natural Science Foundation of China
3. National Science Foundation of China
4. NNSF of China
5. NSF of China
6. 国家自然科学基金委员会
7. National Nature Science Foundation of China
8. Guójiā Zìrán Kēxué Jījīn Wěiyuánhuì
9. NSFC
10. NNSF
11. NNSFC
Awards4
1. 91130005
2. 91530322
3. 11501039
4. U1430237
Office of Naval Research 10.13039/100000006
Region: Americas
gov (National government)
Labels6
1. U.S. Office of Naval Research
2. Naval Research
3. United States Office of Naval Research
4. U.S. Department of the Navy Office of Naval Research
5. The Office of Naval Research
6. ONR
Awards1
1. N00014-13-1-0338
U.S. Department of Energy 10.13039/100000015
Region: Americas
gov (National government)
Labels8
1. Energy Department
2. Department of Energy
3. United States Department of Energy
4. ENERGY.GOV
5. US Department of Energy
6. USDOE
7. DOE
8. USADOE
Awards2
1. DE-SC0009248
2. DE-SC0008626
National Key Research and Development Program of China 10.13039/501100012166
Region: Asia
gov (National government)
Labels16
1. 重点基础研究发展计划
2. National Basic Research Program of China (973 Program)
3. Special Fund for the National Key Research and Development Plan
4. China National Key Research and Development Plan Project
5. National Key Research and Development of China
6. National Key Research and Development Program
7. National Key R&D Program of China
8. National Key R&D Programmes of China
9. China's National Key R&D Programmes
10. National Basic Research Program of China
11. 973 Program
12. National Program on Key Basic Research Project (973 Program)
13. National Plan on Key Basic Research and Development
14. National Basic Research Program
15. NKRDPC
16. NKPs
Awards2
1. 2016YFB0201200
2. 2016YFB0201203
Science Challenge
Awards1
1. JCKY2016212A502

BibTeX

@article{Zhang_2018, title={Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy of Quantum Mechanics}, volume={120}, ISSN={1079-7114}, url={http://dx.doi.org/10.1103/physrevlett.120.143001}, DOI={10.1103/physrevlett.120.143001}, number={14}, journal={Physical Review Letters}, publisher={American Physical Society (APS)}, author={Zhang, Linfeng and Han, Jiequn and Wang, Han and Car, Roberto and E, Weinan}, year={2018}, month=apr }

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