基于现场同步仪测量实时反的Cu氧化状态的活性反应控制
Yevgeny Rakita1, Daniel O'Nolan2, Rebecca D McAuliffe3
1Department of Applied Physics and Applied Mathematics, Columbia University, New York, New York 10027, United States.
Journal of the American Chemical Society
|October 22, 2020
概括
研究人员开发了一种用于材料合成的自动化算法,使用实时X射线光谱反来控制反应. 这极大地加速了新材料的发现和优化,包括催化剂.
科学领域:
- 材料科学
- 化学工程
- 催化研究
背景情况:
- 传统的材料合成包括在反应结束后进行代,耗时的参数调整.
- 优化材料性能往往需要广泛的实验和人类干预.
- 在反应过程中实时的化学反对于有效的过程控制至关重要.
研究的目的:
- 开发和演示实现目标材料状态的自动化系统.
- 减少材料发现和合成优化所需的时间和人力.
- 通过闭环,现场控制在材料研究中建立一个新范式.
主要方法:
- 使用递归算法实时控制材料反应.
- 在现场使用X射线吸收光谱来监测系统化学.
- 整合了一个反循环,将材料特征与反应条件和决策算法连接起来.
主要成果:
- 成功控制了氧气和气的部分压力.
- 达到了1+的目标平均铜氧化状态.
- 证明了在单个反应周期内代反应参数的能力.
结论:
- 开发的方法可以自主控制材料合成,加速发现.
- 这种反驱动的方法比传统的代合成协议有显著的进步.
- 概念验证很容易用于优化和理解各种化学系统,特别是催化.
相关概念视频
Redox Reactions
57.8K
Oxidation-reduction or redox reactions involve the transfer of electrons from one molecule or atom to another. When an atom gains an electron, another atom must lose an electron, meaning oxidation and reduction must occur together. Since the redox occurs in pairs, the atom that gets oxidized is also called the reducing agent or reductant, and the atom that is reduced is also called the oxidizing agent or oxidant. A straightforward way to remember the definitions of oxidation and reduction is...
57.8K
Redox Reactions
619
Redox reactions are vital biochemical processes that underpin energy metabolism in cells. These reactions involve the transfer of electrons between molecules, occurring in tandem as oxidation and reduction. Oxidation refers to the loss of electrons, while reduction denotes their gain. This coupling ensures the seamless flow of electrons through metabolic pathways. For example, in bacterial metabolism, glucose undergoes oxidation to carbon dioxide, while oxygen is simultaneously reduced to...
619
Redox Titration: Overview
4.3K
Redox titration is a chemical analysis technique used to determine the concentration of an unknown substance by measuring the electron transfer in a redox (reduction-oxidation) reaction. The process involves gradually adding a titrant with a known concentration of an oxidizing or reducing agent, to the analyte, the solution with an unknown concentration, until reaching the endpoint, which indicates the completion of the reaction between the two substances. Ensuring the analyte is in a single...
4.3K
Redox Equilibria: Overview
1.4K
A reduction-oxidation reaction is commonly called a redox reaction. In a redox reaction, electrons are transferred from one species to another rather than being shared between or among atoms. The reducing agent or reductant is the species that loses electrons and gets oxidized in the process. The species that gains electrons and gets reduced in the process is the oxidizing agent or oxidant. Redox reactions are represented as two separate equations called half-reactions, where one equation...
1.4K
Controlled-Current Coulometry: Overview
508
Controlled current coulometry, also known as amperostatic coulometry, is a technique used in electrochemical analysis to measure the quantity of a substance through the controlled passage of current. It involves the application of a constant current to an electrochemical cell containing the analyte of interest. As the current flows through the cell, the analyte undergoes a redox reaction at the electrode surface, resulting in a charge transfer. By monitoring the time required for a certain...
508
Redox Titration: Other Oxidizing and Reducing Agents
914
Besides iodine, other oxidizing or reducing agents can serve as titrants in redox titrations. Common oxidizing titrants include KMnO4, cerium(IV), and K2Cr2O7. The choice of oxidizing titrants depends on factors like stability, cost, analyte strength, and reaction rate between the analyte and titrant. KMnO4 is a strong oxidizing titrant that reduces from Mn(VII) to Mn(II) in a highly acidic solution, simultaneously oxidizing the analyte to a higher oxidation state. In this case, KMnO4 acts as a...
914


