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Competitive adsorption of exchangeable Al 3+on the surface of lignosulfonate contributes to reducing soil acidification while improving soil fertility: Findings from a density functional theory calculation
期刊论文
ENVIRONMENTAL TECHNOLOGY & INNOVATION, 2024, 卷号: 35, 页码: 11
作者:
He, Debo
;
Dong, Zhixin
;
Zhu, Bo
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浏览/下载:0/0
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提交时间:2024/08/14
Soil acidification
ExchangeableAl3+
Soil amendment
Calcium lignosulfonate
DFT calculation
Enhanced peroxymonosulfate activation by hierarchical porous Fe3O4/Co3S4 nanosheets for efficient elimination of rhodamine B: Mechanisms, degradation pathways and toxicological analysis
期刊论文
JOURNAL OF COLLOID AND INTERFACE SCIENCE, 2022, 卷号: 610
作者:
Shi, Xu
;
Hong, Peidong
;
Huang, Hongqi
;
Yang, Dandan
;
Zhang, Kaisheng
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  |  
浏览/下载:88/0
  |  
提交时间:2022/03/28
RhB degradation
Fe3O4/Co3S4
PMS activation
DFT calculation
Toxicity
Room temperature Raman spectroscopy and Si-29 MAS NMR combined with high temperature Raman spectroscopy and DFT calculation of xMgO-(1-x) CaO-SiO2 glasses and melts
期刊论文
CERAMICS INTERNATIONAL, 2022, 卷号: 48
作者:
Gong, Xiaoye
;
Wang, Jian
;
You, Jinglin
;
Wang, Min
;
Tang, Xiaohui
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  |  
浏览/下载:86/0
  |  
提交时间:2022/03/28
In-situ Raman spectroscopy
29 Si MAS NMR
DFT calculation
Quantitative analysis
A novel pyrazoline-based fluorescence probe armed by pyrene and naphthol system for the selective detection of Cu2+ and its biological application
期刊论文
JOURNAL OF THE IRANIAN CHEMICAL SOCIETY, 2022
作者:
Yang, Yun-Shang
;
Cao, Jing-Qi
;
Ma, Chun-Mei
;
Zhang, Ying-Peng
;
Guo, Hui-Chen
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  |  
浏览/下载:20/0
  |  
提交时间:2022/04/21
Pyrazoline
Fluorescent chemosensor
Copper ions
DFT calculation
Cell imaging
A novel ion-pair strategy for efficient separation of lithium isotopes using crown ethers
期刊论文
SEPARATION AND PURIFICATION TECHNOLOGY, 2021, 卷号: 274, 页码: 12
作者:
Cui, Li
;
Li, Shasha
;
Kang, Jin
;
Yin, Caixia
;
Guo, Yanxia
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浏览/下载:17/0
  |  
提交时间:2021/08/31
Lithium Isotopes
Crown Ethers
Ion Pair
Urey Model
Dft Calculation
Highly sensitive and selective electrochemical detection of Pb(II) in serum via an alpha-Fe2O3/NiO heterostructure: Evidence from theoretical calculations and adsorption investigation
期刊论文
SENSORS AND ACTUATORS B-CHEMICAL, 2021, 卷号: 344
作者:
Wei, Juan
;
Zhao, Jie
;
Li, Chun-Yang
;
Xie, Xiao-Yu
;
Wei, Yuan-Yuan
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浏览/下载:82/0
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提交时间:2021/08/30
alpha-Fe2O3/NiO heterostructure
Electroanalysis of Pb(II)
Highly sensitive and selective
Density functional theory (DFT) calculation
Serum sample
3, 4-seco-Isopimarane and 3, 4-seco-pimarane diterpenoids from Callicarpa nudiflora
期刊论文
CHINESE JOURNAL OF NATURAL MEDICINES, 2021, 卷号: 19, 期号: 8, 页码: 632-640
作者:
Huang, Hang
;
Tang, Chun-Ping
;
Ke, Chang-Qiang
;
Shu, Ren-Geng
;
Ye, Yang
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  |  
浏览/下载:44/0
  |  
提交时间:2021/11/04
TDDFT-ECD
DFT calculation
Callicarpa nudiflora
3
4-seco-Isopimarane
3
4-seco-Pimarane
Waste to wealth: Defect-rich Ni-incorporated spent LiFePO4 for efficient oxygen evolution reaction
期刊论文
SCIENCE CHINA-MATERIALS, 2021, 页码: 9
作者:
Cui, Baihua
;
Liu, Chang
;
Zhang, Jinfeng
;
Lu, Jijun
;
Liu, Siliang
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  |  
浏览/下载:26/0
  |  
提交时间:2021/08/31
functional conversion
spent cathode
LiFePO4
oxygen evolution reaction
DFT calculation
Iron-modulated nickel cobalt phosphide embedded in carbon to boost power density of hybrid sodium-air battery
期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2021, 卷号: 285, 页码: 11
作者:
Kang, Yao
;
Wang, Shuo
;
Zhu, Siqi
;
Gao, Haixing
;
Hui, Kwan San
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  |  
浏览/下载:78/0
  |  
提交时间:2021/04/07
Iron doping
Nickel cobalt phosphide
Electronic structure reformation
DFT calculation
Hybrid sodium-air battery
Atomic insights into the thermal runaway process of hydrogen peroxide and 1,3,5-trimethybenzene mixture: Combining ReaxFF MD and DFT methods
期刊论文
PROCESS SAFETY AND ENVIRONMENTAL PROTECTION, 2021, 卷号: 147, 页码: 578-588
作者:
Qian, Yanan
;
Xu, Wei
;
Zhan, Jin-Hui
;
Jia, Xuewu
;
Zhang, Fan
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  |  
浏览/下载:17/0
  |  
提交时间:2021/08/31
Hydrogen Peroxide
Organics
Reaxff Md
Dft Calculation
Thermal Runaway
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