五倍子磷酸盐苜蓿石--用于环境修复的前景广阔的吸附剂......?

IF 1.9 4区 化学 Q4 CHEMISTRY, PHYSICAL Molecular Simulation Pub Date : 2024-08-30 DOI:10.1080/08927022.2024.2396088
Michael Fischer
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引用次数: 0

摘要

最近的几项分子模拟研究提出,五倍子磷酸盐沸石型苜蓿石或苜蓿石型材料是一种很有前途的吸附剂,可用于去除水中的各种污染物。T...
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The gallophosphate cloverite – A promising adsorbent for environmental remediation … ?*
Several recent molecular simulation studies proposed the gallophosphate zeotype cloverite, or cloverite-type materials, as promising adsorbents for the removal of various contaminants from water. T...
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来源期刊
Molecular Simulation
Molecular Simulation 化学-物理:原子、分子和化学物理
CiteScore
3.80
自引率
9.50%
发文量
128
审稿时长
3.1 months
期刊介绍: Molecular Simulation covers all aspects of research related to, or of importance to, molecular modelling and simulation. Molecular Simulation brings together the most significant papers concerned with applications of simulation methods, and original contributions to the development of simulation methodology from biology, biochemistry, chemistry, engineering, materials science, medicine and physics. The aim is to provide a forum in which cross fertilization between application areas, methodologies, disciplines, as well as academic and industrial researchers can take place and new developments can be encouraged. Molecular Simulation is of interest to all researchers using or developing simulation methods based on statistical mechanics/quantum mechanics. This includes molecular dynamics (MD, AIMD), Monte Carlo, ab initio methods related to simulation, multiscale and coarse graining methods.
期刊最新文献
Exploring the anti-inflammatory potential of phytochemicals against STING::TBK1 pathway A comprehensive analysis of the spectroscopic and drug-like properties of dimethyl 5-hydroxybenzene-1,3-dicarboxylate: insights from DFT and MD simulations Molecular model construction of bituminous coal and its oxygen adsorption characteristics under different moisture conditions The gallophosphate cloverite – A promising adsorbent for environmental remediation … ?* Theoretical investigation of mixed-metal metal-organic frameworks as H2 adsorbents: insights from GCMC and DFT simulations
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