@@ -2408,3 +2408,27 @@ @Article{Gu_ScienceBulletin_2022_v67_p29
24082408 doi = { 10.1016/j.scib.2021.09.010} ,
24092409}
24102410
2411+ @Article {Zhang_PhysRevLett_2018_v120_p143001 ,
2412+ author = { Linfeng Zhang and Jiequn Han and Han Wang and Roberto Car and Weinan E} ,
2413+ title = { {Deep Potential Molecular Dynamics: A Scalable Model with the Accuracy
2414+ of Quantum Mechanics}} ,
2415+ journal = { Phys. Rev. Lett.} ,
2416+ year = 2018 ,
2417+ volume = 120 ,
2418+ issue = 14 ,
2419+ pages = 143001 ,
2420+ annote = { We introduce a scheme for molecular simulations, the deep potential
2421+ molecular dynamics (DPMD) method, based on a many-body potential and
2422+ interatomic forces generated by a carefully crafted deep neural
2423+ network trained with ab{~}initio data. The neural network model
2424+ preserves all the natural symmetries in the problem. It is first-
2425+ principles based in the sense that there are no ad{~}hoc components
2426+ aside from the network model. We show that the proposed scheme
2427+ provides an efficient and accurate protocol in a variety of systems,
2428+ including bulk materials and molecules. In all these cases, DPMD gives
2429+ results that are essentially indistinguishable from the original data,
2430+ at a cost that scales linearly with system size.} ,
2431+ doi = { 10.1103/PhysRevLett.120.143001} ,
2432+ image = { https://journals.aps.org/prl/article/10.1103/PhysRevLett.120.143001/figures/1/thumbnail} ,
2433+ }
2434+
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