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Experimental measurement and thermodynamic modeling of dissociation conditions of hydrogen sulfide hydrate in the presence of electrolyte solutions
期刊论文
Chemical Engineering Journal, 2022, 卷号: 2022, 期号: 431, 页码: 133821
作者:
Sun Jiyue
;
Sun Rui
;
Chou I−Ming
;
Anh V. Nguyen
;
Jiang Lei
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浏览/下载:0/0
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提交时间:2022/01/10
Hydrogen sulfide hydrate
Dissociation conditions
Electrolytes
Thermodynamic model
Vacuum ultraviolet photochemistry of sulfuric acid vapor: a combined experimental and theoretical study
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2022, 卷号: 24
作者:
Zhang, Cuihong
;
Lin, Xiaoxiao
;
Tang, Xiaofeng
;
Fittschen, Christa
;
Hartweg, Sebastian
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浏览/下载:27/0
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提交时间:2022/02/14
Structure effect on intrinsic piezoelectricity in septuple-atomic-layer MSi2N4 (M=Mo and W)
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 188, 页码: 8
作者:
Guo, San-Dong
;
Zhu, Yu-Tong
;
Mu, Wen-Qi
;
Wang, Lei
;
Chen, Xing-Qiu
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浏览/下载:19/0
  |  
提交时间:2021/10/15
MA(2)Z(4) family
Piezoelectronics
2D materials
Physically inspired atom-centered symmetry functions for the construction of high dimensional neural network potential energy surfaces
期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2021, 卷号: 186, 页码: 7
作者:
Zhang, Kangyu
;
Yin, Lichang
;
Liu, Gang
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浏览/下载:40/0
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提交时间:2021/03/15
Machine learning
Potential energy surface
Atom centered symmetry function
Solid electrolyte
Molecular dynamics simulation
First-principles comprehensive study of electronic and mechanical properties of novel uranium hydrides at different pressures
期刊论文
PROGRESS IN NATURAL SCIENCE-MATERIALS INTERNATIONAL, 2020, 卷号: 30, 期号: 2, 页码: 251-259
作者:
Liu, Min
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浏览/下载:26/0
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提交时间:2021/02/02
Uranium hydrides
Structure search
Electronic properties
Mechanical properties
First-principles calculations
Studies on temperature characteristics and initial formation interface during cyclopentane-methane hydrate formation in large-scale equipment with bubbling
期刊论文
APPLIED ENERGY, 2020, 卷号: 258, 页码: 11
作者:
Cai, Jing
;
Lv, Tao
;
Zhang, Yu
;
von Solms, Nicolas
;
Xu, Chun-Gang
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浏览/下载:30/0
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提交时间:2020/10/29
Temperature characteristics
Heat
Cyclopentane
Hydrate formation interface
Thermodynamic description of the Dy-Si-C system in silicon carbide ceramics
期刊论文
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY, 2020, 卷号: 68
作者:
Xu, Kai
;
Chen, Leilei
;
Chang, Keke
;
Wan, Peng
;
Li, Mian
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浏览/下载:16/0
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提交时间:2020/12/16
TOTAL-ENERGY CALCULATIONS
RARE-EARTH SILICIDES
ENTHALPIES
CARBON
FABRICATION
TRANSFORMATION
DYSPROSIUM
GERMANIDES
DICARBIDES
HOSI1.67
Unexpected Roles of Alkali-Metal Cations in the Assembly of Low-Valent Uranium Sulfate Molecular Complexes
期刊论文
INORGANIC CHEMISTRY, 2020, 卷号: 59, 期号: 4, 页码: 2348-2357
作者:
Yue, ZH
;
Guo, XF
;
Feng, ML
;
Lin, YJ
;
Ju, Y
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浏览/下载:35/0
  |  
提交时间:2021/09/06
STATE STRUCTURAL CHEMISTRY
DIMENSIONAL REDUCTION
CRYSTAL-STRUCTURE
FISSION-PRODUCTS
CLUSTER
HEXANUCLEAR
COORDINATION
SPECIATION
HYDROLYSIS
SELENITES
The phase equilibria of the Ti-V-M (M = Si, Nb, Ta) ternary systems
期刊论文
INTERMETALLICS, 2020, 卷号: 118, 页码: -
作者:
Hu, B
;
Yao, B
;
Wang, J
;
Liu, Y
;
Wang, CJ
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  |  
浏览/下载:5/0
  |  
提交时间:2021/09/06
TOTAL-ENERGY CALCULATIONS
REGULAR SOLUTION MODEL
THERMODYNAMIC CALCULATION
BINARY
CR
Understanding of role of Li in high-performance Pb-free Li-doped (Ba0.85Ca0.15)(Ti-0.9 Zr-0.1)O-3 piezoceramics from theory and experiments
期刊论文
MATERIALS CHEMISTRY AND PHYSICS, 2019, 卷号: 231, 页码: 173
作者:
Chen, Xiaoming
;
Zeng, Jiangtao
;
Kim, Dokyun
;
Zheng, Liaoying
;
Lou, Qiwei
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  |  
浏览/下载:44/0
  |  
提交时间:2019/12/26
Lead-free ceramics
Activation energy
Phase transitions
Impurities
First-principles calculations
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