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浏览/检索结果:
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A Machine Learning Model to Classify Dynamic Processes in Liquid Water**
期刊论文
CHEMPHYSCHEM, 2022
作者:
Huang, Jie
;
Huang, Gang
;
Li, Shiben
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2023/01/16
JUMP MECHANISM
CLUSTERS
EXCHANGE
SPECTROSCOPY
DIFFUSION
NETWORKS
CELL
Unprecedented differences in the diamond nucleation density between carbon- and silicon-faces of 4H-silicon carbides
期刊论文
CHINESE CHEMICAL LETTERS, 2020, 卷号: 31, 期号: 7, 页码: 2013-2018
作者:
Wang, Bo
;
Sukkaew, Pitsiri
;
Song, Guichen
;
Rosenkranz, Andreas
;
Lu, Yunxiang
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  |  
浏览/下载:113/0
  |  
提交时间:2020/12/16
MOLECULAR CALCULATIONS
GROWTH-MECHANISM
AB-INITIO
NANOCRYSTALLINE
THERMOCHEMISTRY
ADSORPTION
HYDROGEN
ATOMS
Ab initio thermodynamic optimization of Ni-rich Ni-Co-Mn oxide cathode coatings
期刊论文
JOURNAL OF POWER SOURCES, 2020, 卷号: 450
作者:
Liu, Bo
;
Liu, Jian
;
Yang, Jiong
;
Wang, Da
;
Ye, Caichao
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  |  
浏览/下载:39/0
  |  
提交时间:2020/12/16
IMPROVED ELECTROCHEMICAL PERFORMANCE
POSITIVE-ELECTRODE MATERIALS
ATOMIC LAYER DEPOSITION
LINI0.5CO0.2MN0.3O2 CATHODE
THERMAL-STABILITY
CYCLING PERFORMANCE
1ST PRINCIPLES
SIGNIFICANT IMPROVEMENT
PHOSPHO-OLIVINES
LITHIUM
Macroscale Superlubricity Enabled by Graphene-Coated Surfaces
期刊论文
ADVANCED SCIENCE, 2020, 卷号: 7, 期号: 4
作者:
Zhang, Zhenyu
;
Du, Yuefeng
;
Huang, Siling
;
Meng, Fanning
;
Chen, Leilei
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  |  
浏览/下载:27/0
  |  
提交时间:2020/12/16
ULTRA-LOW FRICTION
RAMAN-SPECTROSCOPY
NITROGEN ATMOSPHERE
MOLECULAR-DYNAMICS
FILMS
OXIDE
LUBRICANT
SUBSTRATE
ADHESION
WEAR
Highly Localized C-N2 Sites for Efficient Oxygen Reduction
期刊论文
ACS CATALYSIS, 2020, 卷号: 10, 期号: 16, 页码: 9366-9375
作者:
Ju, Qiangjian
;
Ma, Ruguang
;
Hu, Yifan
;
Guo, Beibei
;
Liu, Qian
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  |  
浏览/下载:48/0
  |  
提交时间:2020/12/16
N-DOPED CARBON
HIERARCHICALLY POROUS CARBON
METAL-FREE ELECTROCATALYSTS
TRIAZINE-BASED FRAMEWORK
BIFUNCTIONAL CATALYSTS
ACTIVE-SITES
EVOLUTION
GRAPHENE
ORR
NANOSHEETS
Corrosion behavior of diamond-like carbon film induced by Al/Ti co-doping
期刊论文
APPLIED SURFACE SCIENCE, 2020, 卷号: 509
作者:
Xu, Xiaowei
;
Zhou, Yong
;
Liu, Linlin
;
Guo, Peng
;
Li, Xiaowei
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  |  
浏览/下载:8/0
  |  
提交时间:2020/12/16
DLC FILMS
TRIBOLOGICAL PROPERTIES
SURFACE CHARACTERISTICS
RESISTANCE PROPERTIES
STAINLESS-STEEL
AB-INITIO
COATINGS
PROTECTION
WEAR
TI
Biotransformation Mechanism of Pesticides by Cytochrome P450: A DFT Study on Dieldrin
期刊论文
CHEMICAL RESEARCH IN TOXICOLOGY, 2020, 卷号: 33, 期号: 6, 页码: 1442-1448
作者:
Chai, Lihong
;
Ji, Shujing
;
Zhang, Shubin
;
Yu, Haiying
;
Zhao, Meirong
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  |  
浏览/下载:25/0
  |  
提交时间:2020/08/07
C-H HYDROXYLATION
AB-INITIO
HYDROGEN ABSTRACTION
HUMAN METABOLISM
DRUG-METABOLISM
COMPOUND-I
ENZYMES
POTENTIALS
POPULATION
PREDICTION
Room-Temperature Bound Exciton with Long Lifetime in Monolayer GaN
期刊论文
ACS PHOTONICS, 2018, 卷号: 5, 期号: 10, 页码: 4081-4088
作者:
Lu, Hongliang
;
Zhu, Heyuan
;
Peng, Bo
;
Zhang, Hao
;
Shao, Hezhu
收藏
  |  
浏览/下载:72/0
  |  
提交时间:2018/12/04
1st Principles Calculations
Ab-initio Calculation
Energy
Semiconductors
Excitations
Insulators
Absorption
Spectra
Room-Temperature Bound Exciton with Long Lifetime in Monolayer GaN
期刊论文
ACS PHOTONICS, 2018, 卷号: 5, 期号: 10, 页码: 4081-4088
作者:
Zhang, Hao
;
Peng, Bo
;
Shao, Hezhu
;
Xu, Ke
;
Ni, Gang
收藏
  |  
浏览/下载:36/0
  |  
提交时间:2018/12/04
1st Principles Calculations
Ab-initio Calculation
Energy
Semiconductors
Excitations
Insulators
Absorption
Spectra
Metastable phase formation of Pt-X (X = Ir, Au) thin films
期刊论文
SCIENTIFIC REPORTS, 2018, 卷号: 8
作者:
Voelker, Bernhard
;
Saksena, Aparna
;
Chien, Yu-Chuan
;
Chang, Keke
;
Kuemmerl, Pauline
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  |  
浏览/下载:33/0
  |  
提交时间:2018/12/04
Glass Molding Tools
Platinum
Iridium
System
Alloys
Combinatorial
Coatings
Metals
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