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Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoO
x
S
4-
x
2-
Species in the Aqueous Phase by the ONIOM Method
期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2023, 卷号: 7, 期号: 1, 页码: 142-155
作者:
He, Yuyang
;
Gao, Caihong
;
Wei, Wei
;
Liu, Yun
收藏
  |  
浏览/下载:0/0
  |  
提交时间:2024/01/08
paleoredox proxy
ab initio molecular dynamics
implicit solvent model
dispersion correction
water-droplet
periodical boundary condition
Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoOxS4-x2- Species in the Aqueous Phase by the ONIOM Method
期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 14
作者:
He YY(何雨旸)
;
Gao,Caihong
;
Wei,Wei
;
Liu,Yun
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  |  
浏览/下载:17/0
  |  
提交时间:2023/02/03
paleoredox proxy
ab initio molecular dynamics
implicit solvent model
dispersion correction
water-droplet
periodical boundary condition
Engineering an Insoluble Cathode Electrolyte Interphase Enabling High Performance NCM811//Graphite Pouch Cell at 60 degrees C
期刊论文
ADVANCED ENERGY MATERIALS, 2022, 页码: 14
作者:
Chen, Yuqing
;
He, Qiu
;
Mo, Ying
;
Zhou, Wang
;
Zhao, Yun
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  |  
浏览/下载:52/0
  |  
提交时间:2022/09/16
cathode electrolyte interphases
dynamic evolution
electrolyte additives
high temperatures
in situ FTIR
unsaturation
Line identification of extreme ultraviolet spectra ofMo V to Mo XVIII in EAST tokamak br
期刊论文
ACTA PHYSICA SINICA, 2022, 卷号: 71
作者:
Zhang Wen-Min
;
Zhang Ling
;
Cheng Yun-Xin
;
Wang Zheng-Xiong
;
Hu Ai-Lan
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  |  
浏览/下载:14/0
  |  
提交时间:2022/12/22
EAST tokamak
extreme ultraviolet spectra
molybdenum impurity
line identification
Implications for the Nb aggregation inherited from melt to gamma phase of U-Nb alloy
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2021, 卷号: 885, 页码: 13
作者:
Shi, Yongpeng
;
Zhu, Heyu
;
Wang, Jiantao
;
Ma, Hui
;
Li, Ronghan
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  |  
浏览/下载:69/0
  |  
提交时间:2021/11/22
U-Nb alloy
Nb aggregation
Uniform distribution
Mechanical property
Hydrogen diffusion behavior
Ab initio study of dynamical properties of U-Nb alloy melt*
期刊论文
CHINESE PHYSICS B, 2021, 卷号: 30, 期号: 12, 页码: 8
作者:
Shi, Yong-Peng
;
Liu, Ming-Feng
;
Chen, Yun
;
Mo, Wen-Lin
;
Li, Dian-Zhong
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  |  
浏览/下载:14/0
  |  
提交时间:2022/07/01
U-Nb alloy melt
dynamical properties
ab initio study
Neutronics analysis of a stacked structure for a subcritical system with LEU solution driven by a D-T neutron source for Mo-99 production
期刊论文
NUCLEAR SCIENCE AND TECHNIQUES, 2021, 卷号: 32
作者:
Ren, Lei
;
Han, Yun-Cheng
;
Zhang, Jia-Chen
;
Wang, Xiao-Yu
;
Li, Tao-Sheng
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  |  
浏览/下载:15/0
  |  
提交时间:2022/01/10
Neutronics analysis
Stacked structure
Mo-99 yield
Subcritical system
D-T neutron source
A graphene-Mo2C heterostructure for a highly responsive broadband photodetector
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2021, 页码: 8
作者:
Bao, Xiaozhi
;
Sun, Tian
;
Liu, Yan
;
Xu, Chuan
;
Ma, Weiliang
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  |  
浏览/下载:28/0
  |  
提交时间:2021/11/22
Study on the adsorption performance of Ni-Mo-S nanomaterials for Congo red in azo wastewater
期刊论文
DESALINATION AND WATER TREATMENT, 2021, 卷号: 234
作者:
Sun, Bai
;
Cheng, Yunming
;
Xu, Fangwen
;
Liu, Fei
;
Zhang, Jie
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  |  
浏览/下载:61/0
  |  
提交时间:2021/11/29
Ni-Mo-S
Nanomaterial
Adsorption
Dye wastewater
Neutronics study of a subcritical system driven by external neutron source for Mo-99 production
期刊论文
FUSION ENGINEERING AND DESIGN, 2021, 卷号: 165
作者:
Ren, Lei
;
Li, Zi-Wei
;
Han, Yun-Cheng
;
Wang, Xiao-Yu
;
Zhang, Jia-Chen
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  |  
浏览/下载:26/0
  |  
提交时间:2021/05/06
Medical radioisotope Mo-99
Neutronics
Sub-critical system
LEU solution
UO2SO4
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