机构

• 金属研究所 [7]
• 过程工程研究所 [6]
• 长春应用化学研究所 [6]
• 力学研究所 [4]
• 大连化学物理研究所 [4]
• 近代物理研究所 [3]
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• OAI收割 [43]
• iSwitch采集 [1]

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• 期刊论文 [43]
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• 2024 [1]
• 2022 [2]
• 2021 [2]
• 2020 [1]
• 2019 [2]
• 2018 [2]
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学科主题

• Coal [1]
• Ionic Liqu... [1]
• Materials ... [1]
• 半导体物理 [1]
• 支撑与管理::仿真与... [1]

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浏览/检索结果: 共44条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 Effects of Chemical Short-Range Order and Lattice Distortion on Crack-Tip Behavior of Medium-Entropy Alloy by Atomistic Simulations 期刊论文  OAI收割 METALS, 2024, 卷号: 14, 期号: 2, 页码: 14 作者:  Zhu, Xiuju;  Cao, Fuhua;  Dai, Lanhong;  Chen, Yan;  Dai LH(戴兰宏)   |  收藏  |  浏览/下载：28/0  |  提交时间：2024/04/02 chemical short-range order  lattice distortion  J-integral  localized deformation zone  crack  molecular dynamics   Chemical structure effects on coal pyrolyzates and reactions by using large-scale reactive molecular dynamics 期刊论文  OAI收割 Fuel, 2022, 卷号: 327 作者:  Zheng, Mo;  Li, Xiaoxia;  Bai, Jin;  Guo, Li   |  收藏  |  浏览/下载：0/0  |  提交时间：2023/06/26 Cracking (chemical) - Indicators (chemical) - Mapping - Molecular dynamics - Reaction kinetics - Structure (composition) - Temperature - Thermogravimetric analysis   Ionic liquid regulated interfacial polymerization process to improve acid-resistant nanofiltration membrane permeance 期刊论文  OAI收割 Journal of Membrane Science, 2022, 卷号: 641 作者:  Bai, Ju;  Lai, Wei;  Gong, Lili;  Xiao, Luqi;  Wang, Guosheng   |  收藏  |  浏览/下载：0/0  |  提交时间：2023/06/26 Molecular dynamics - Morphology - Nanofiltration - Polymerization - Nanofiltration membranes - Chlorine compounds - Acid resistance - Chemical analysis - Surface morphology - Pore size   Coupled Strengthening Effects by Lattice Distortion, Local Chemical Ordering, and Nanoprecipitates in Medium-Entropy Alloys 期刊论文  OAI收割 FRONTIERS IN MATERIALS, 2021, 卷号: 8, 页码: 12 作者:  Cheng, Wenqiang;  Yuan, Fuping;  Wu, Xiaolei;  Yuan FP(袁福平);  Wu XL(武晓雷)   |  收藏  |  浏览/下载：79/0  |  提交时间：2022/01/13 high-entropy alloys  lattice distortion  local chemical ordering  precipitation  strengthening mechanisms  molecular dynamics simulations   Understanding the effects of salinity on bitumen-calcite interactions 期刊论文  OAI收割 FUEL PROCESSING TECHNOLOGY, 2021, 卷号: 213 作者:  Wang, Junyan;  Bai, Yun;  Sui, Hong;  Li, Xingang;  He, Lin   |  收藏  |  浏览/下载：21/0  |  提交时间：2021/12/01 MOLECULAR-DYNAMICS SIMULATIONS  GENERAL FORCE-FIELD  IMPROVED OIL-RECOVERY  CHEMICAL-TRACER TESTS  SURFACE-STRUCTURE  CARBONATE/BRINE INTERFACE  ASPHALTENE ADSORPTION  WATER  WETTABILITY  IMPACT   Novel atomic-scale mechanism of incipient plasticity in a chemically complex CrCoNi medium-entropy alloy associated with inhomogeneity in local chemical environment 期刊论文  OAI收割 ACTA MATERIALIA, 2020, 卷号: 194, 页码: 283-294 作者:  Cao FH(曹富华);  Wang YJ(王云江);  Dai LH(戴兰宏)   |  收藏  |  浏览/下载：41/0  |  提交时间：2020/08/26 Dislocation nucleation  Medium-entropy alloy  Local chemical order  Molecular dynamics  Density functional theory   Susceptibility of shear banding to chemical short-range order in metallic glasses 期刊论文  OAI收割 SCRIPTA MATERIALIA, 2019, 卷号: 162, 页码: 141-145 作者:  Yang ZY;  Wang YJ(王云江);  Dai LH(戴兰宏)   |  收藏  |  浏览/下载：60/0  |  提交时间：2019/04/11 Metallic glasses  Shear bands  Chemical short-range order  Molecular dynamics   Atomistic understanding on friction behavior of amorphous carbon films induced by surface hydrogenated modification 期刊论文  OAI收割 TRIBOLOGY INTERNATIONAL, 2019, 卷号: 136, 页码: 446-454 作者:  Li, Xiaowei;  Wang, Aiying;  Lee, Kwang-Ryeol   |  收藏  |  浏览/下载：18/0  |  提交时间：2019/12/18 DIAMOND-LIKE CARBON  CHEMICAL MOLECULAR-DYNAMICS  GRAPHITIZATION  MECHANISM  WEAR  DEPENDENCE  COATINGS   Computational chemical biology and drug design: Facilitating protein structure, function, and modulation studies 期刊论文  OAI收割 MEDICINAL RESEARCH REVIEWS, 2018, 卷号: 38, 期号: 3, 页码: 914-950 作者:  Zheng, Mingyue;  Zhao, Jihui;  Cui, Chen;  Fu, Zunyun;  Li, Xutong   |  收藏  |  浏览/下载：58/0  |  提交时间：2019/01/08 ADMET  chemical biology  drug design  in silico  lead optimization  molecular dynamics  polypharmacology  virtual screening   Host-guest interaction of styrene and ethylbenzene in MIL-53 studied by solid-state NMR 期刊论文  OAI收割 SOLID STATE NUCLEAR MAGNETIC RESONANCE, 2018, 卷号: 90, 页码: 1-6 作者:  Li, Shenhui;  Li, Jing;  Tang, Jing;  Deng, Feng   |  收藏  |  浏览/下载：21/0  |  提交时间：2018/11/05 Metal-organic Frameworks  Host-guest Interaction  Chemical Separation  Molecular Dynamics  Styrene And Ethylbenzene