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	An emb e dde d-atom method potential for studying the properties of Fe-Pb solid-liquid interface 期刊论文 OAI收割 JOURNAL OF NUCLEAR MATERIALS, 2022, 卷号: 572 作者: Lei, Yawei; Zhang, Jingdan; Zhang, Yange; Li, Xiangyan; Xu, Yichun \| 收藏 \| 浏览/下载：27/0 \| 提交时间：2022/12/23 Fe-Pb system Force -matching method EAM potential Corrosion Liquid properties
	Individual cascade annealing in BCC tungsten: effects of size and spatial distributions of defects 期刊论文 OAI收割 RSC ADVANCES, 2022, 卷号: 12 作者: Wei, Liuming; Zhang, Chuanguo; Zheng, Qirong; Zeng, Zhi; Li, Yonggang \| 收藏 \| 浏览/下载：21/0 \| 提交时间：2022/12/23
	N and O multi-coordinated vanadium single atom with enhanced oxygen reduction activity 期刊论文 OAI收割 JOURNAL OF COLLOID AND INTERFACE SCIENCE, 2021, 卷号: 594 作者: Cheng, Ling; Huang, Hao; Lin, Zhiyu; Yang, Yang; Yuan, Qing \| 收藏 \| 浏览/下载：33/0 \| 提交时间：2021/06/15 Vanadium single atom N, O co-coordination Electrocatalyst Electronic structure Oxygen reduction reaction
	Elastic-plastic deformation decomposition algorithm for metal clusters at the atomic scale 期刊论文 OAI收割 COMPUTATIONAL MECHANICS, 2021, 页码: 15 作者: Yu, Yifan; Cui, Junzhi \| 收藏 \| 浏览/下载：44/0 \| 提交时间：2021/04/26 Micro-nanoscale Elastic– plastic deformation decomposition algorithm Unloading method Intermediate configuration Principle of minimum potential energy Embedded-atom method
	Fe-N-C single-atom catalysts with an axial structure prepared by a new design and synthesis method for ORR 期刊论文 OAI收割 NEW JOURNAL OF CHEMISTRY, 2021, 卷号: 45, 期号: 29, 页码: 13004--13014 作者: BSRF用户 \| 收藏 \| 浏览/下载：7/0 \| 提交时间：2022/09/15
	反应-扩散调控材料成核过程的分子动力学模拟学位论文 OAI收割 : 中国科学院大学, 2020 作者: 窦翔宇 \| 收藏 \| 浏览/下载：45/0 \| 提交时间：2021/09/07 成核,分子动力学模拟,反应,扩散,碰撞
	Development and application of EAM potentials for Ti, Al and Nb with enhanced planar fault energy of Ti 期刊论文 OAI收割 COMPUTATIONAL MATERIALS SCIENCE, 2020, 卷号: 173, 页码: 12 作者: Cheng, Chao; Ma, Yunli; Bao, Qili; Wang, Xun; Sun, Jiaxing \| 收藏 \| 浏览/下载：8/0 \| 提交时间：2021/02/02 EAM potentials Dislocation properties Generalized stacking fault energy First-principles Molecular dynamics
	Modulating Location of Single Copper Atoms in Polymeric Carbon Nitride for Enhanced Photoredox Catalysis 期刊论文 OAI收割 ACS CATALYSIS, 2020, 卷号: 10, 期号: 10, 页码: 5715-5722 作者: Wang, GC; Zhang, T; Yu, WW; Si, R; Liu, YF \| 收藏 \| 浏览/下载：17/0 \| 提交时间：2021/09/06 LIGHT PHOTOCATALYTIC DEGRADATION DISPERSED SILVER ARTIFICIAL PHOTOSYNTHESIS HYDROGEN EVOLUTION ULTRATHIN G-C3N4 SOLAR-ENERGY NANOSHEETS HYBRID NANOPARTICLES
	Simulations of Ti nanoparticles upon heating and cooling on an atomic scale 期刊论文 OAI收割 ACTA PHYSICA SINICA, 2019, 卷号: 68, 期号: 16 作者: Wang YaMing; Liu YongLi; Zhang Lin \| 收藏 \| 浏览/下载：13/0 \| 提交时间：2021/02/02 MOLECULAR-DYNAMICS SIMULATION MECHANICAL-BEHAVIOR BIOMEDICAL APPLICATIONS INTERATOMIC POTENTIALS TITANIUM COALESCENCE MANUFACTURE ALLOY AL metal nanoparticles computer simulation phase transition