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Pretreatment of Lignocellulosic Biomass with Low-cost Ionic Liquids10:42

Pretreatment of Lignocellulosic Biomass with Low-cost Ionic Liquids

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The pretreatment of lignocellulosic biomass with protic low-cost ionic liquids is shown, resulting in a delignified cellulose-rich pulp and a purified lignin. The pulp gives rise to high glucose yields after enzymatic...
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Lewis Symbols and the Octet Rule02:36

Lewis Symbols and the Octet Rule

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Chemical bonds are complex interactions between two or more atoms or ions, which reduce the potential energy of the molecule. Gilbert N. Lewis developed a model called the Lewis model that simplified the depiction of chemical bond formation and provided straightforward explanations for the chemical bonds seen in most common compounds.
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Synthesis of Bimetallic Pt/Sn-based Nanoparticles in Ionic Liquids07:14

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A protocol for the synthesis of bimetallic nanoparticles in ionic liquids and the procedure of their catalytic testing in the selective hydrogenation of unsaturated aldehydes are...
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Ionic Bonding and Electron Transfer02:48

Ionic Bonding and Electron Transfer

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Ions are atoms or molecules bearing an electrical charge. A cation (a positive ion) forms when a neutral atom loses one or more electrons from its valence shell, and an anion (a negative ion) forms when a neutral atom gains one or more electrons in its valence shell. Compounds composed of ions are called ionic compounds (or salts), and their constituent ions are held together by ionic bonds: electrostatic forces of attraction between oppositely charged cations and anions. 
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Regression Toward the Mean01:52

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Regression toward the mean (“RTM”) is a phenomenon in which extremely high or low values—for example, and individual’s blood pressure at a particular moment—appear closer to a group’s average upon remeasuring. Although this statistical peculiarity is the result of random error and chance, it has been problematic across various medical, scientific, financial and psychological applications. In particular, RTM, if not taken into account, can interfere when...
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Elements: Chemical Symbols and Isotopes02:31

Elements: Chemical Symbols and Isotopes

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A chemical symbol is an abbreviation used to indicate an element or an atom of an element. For example, the symbol for mercury is Hg. The same symbol is used to indicate one atom of mercury (microscopic domain) or to label a container of many atoms of the element mercury (macroscopic domain).
Some symbols are derived from the common English name of the element; others are abbreviations of the name in another language — Latin, Greek or German. For example, the symbol for aluminum (common name)...
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相关实验视频

Updated: Jan 20, 2026

Pretreatment of Lignocellulosic Biomass with Low-cost Ionic Liquids
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通过符号回归的离子液体导电性模型.

Isak Bengtsson1, Patrik Johansson1,2,3

  • 1Department of Physics, Chalmers University of Technology, SE-41296, Göteborg, Sweden. isak.bengtsson@chalmers.se.

Physical chemistry chemical physics : PCCP
|January 19, 2026
PubMed
概括

离子液体电解质为传统的离子电池电解质提供了替代品. 本研究使用符号回归和自由体积理论来建模离子导电性,改善电解质性能预测.

科学领域:

  • 材料科学 材料科学 材料科学
  • 电化学 电化学 电化学
  • 计算化学计算化学

背景情况:

  • 传统的离子电池电解质面临着热不稳定等挑战.
  • 离子液体 (ILs) 是一个有前途的替代电解质,但它们的离子运输机制尚未完全理解.

研究的目的:

  • 开发一种用于预测基于IL的电解质中的离子导电性的新型模型.
  • 使用符号回归 (SR) 从自由体积理论 (FVT) 导出分析表达式.

主要方法:

  • 利用符号回归 (SR) 来识别基于自由体积理论 (FVT) 的分析表达式.
  • 使用分子描述符作为模型开发的输入.
  • 验证模型使用内部实验数据 (22 ILs) 和来自文学 (338 ILs) 的大量数据集.

主要成果:

  • 在内部数据集上实现了高相关性 (R2 = 0.97培训,R2 = 0.94验证).
  • 在较大的文献数据集上表现出明显的表现 (R2 = 0.76培训,R2 = 0.73验证).
  • 发现FVT衍生模型对具有良好离合离子的IL表现最好,对具有强离子相互作用的IL表现较差.

结论:

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  • 符号回归与自由体积理论相结合,提供了一种强大的方法来模拟ILs中的离子导电性.
  • 模型性能受到ILs的质量和特征的影响,以及来自不同文献来源的数据变化.
  • 这项工作促进了对IL电解质中离子运输的理解和预测,以提高电池性能.