Toluene-Containing Gas Stream Treatment by Persulfate-Based Oxidation: Process Variables Affecting Mass Transfer [0.03%]
过硫酸盐氧化法处理含甲苯气流：影响传质过程的因素
Ana S P Alves,Carmen S D Rodrigues,João M Miranda et al.
Ana S P Alves et al.
A toluene-containing gas stream was treated through the application of an activated persulfate-based advanced oxidation process (AOP). As in this type of AOP pollutant degradation is carried out in the liquid phase, the gas-to-liquid mass t...
Development of a COSMO-SAC Parametrization with Advanced QM Method TZVPD-FINE [0.03%]
基于高级量子化学方法TZVPD-FINE的COSMO-SAC模型参数化研究
Edgar T de Souza Jr,Murilo L Alcantara,Paula B Staudt et al.
Edgar T de Souza Jr et al.
Accurate prediction of interactions between compounds is essential for designing advanced materials and industrial processes. COSMO-based models have become prominent tools for estimating phase equilibria in complex systems. In this work, a...
Oxidant-Dependent Switch of a Molybdenum(VI) Tetrazolate Complex from a Homogeneous to a Self-Separating Catalyst for Olefin Epoxidation [0.03%]
钼(VI)四氮杂络合物的氧化依赖催化剂转换反应机制用于烯烃环氧化反应中 homogeneous到self-separating催化剂
Martinique S Nunes,Diana M Gomes,Patrícia Neves et al.
Martinique S Nunes et al.
Although several decades have passed since the introduction of homogeneous molybdenum catalysts for the bulk industrial production of epoxides from light olefins, the development of recyclable catalytic systems to produce more complex epoxi...
Direct Air Capture Using Aqueous Amino Acid Solvents in a Crossflow Absorber [0.03%]
采用十字流吸收器使用氨基酸水溶剂的直接空气捕捉技术
Jorge Gabitto,Abishek Kasturi,Gyoung Gug Jang et al.
Jorge Gabitto et al.
Carbon dioxide (CO2) is the most abundant of all greenhouse gases (GHGs). CO2 levels in the atmosphere are 50% higher than in the preindustrial era, trapping heat. CO2 removal from the atmosphere by direct air capture (DAC) is needed to ach...
Generative Multiobjective Bayesian Optimization with Scalable Batch Evaluations for Sample-Efficient De Novo Molecular Design [0.03%]
一种用于从头分子设计的样本有效多目标生成式贝叶斯优化方法及其可扩展批量评估机制
Madhav R Muthyala,Farshud Sorourifar,Tianhong Tan et al.
Madhav R Muthyala et al.
Designing molecules that must satisfy multiple, often conflicting, objectives is a central challenge in molecular discovery. The enormous size of the chemical space and the cost of high-fidelity simulations have driven the development of ma...
Doped Biopolymer Composites for Engineered Water Purification: Mechanistic Insights into Multi-Ion Adsorption [0.03%]
掺杂生物聚合物复合材料用于工程化水净化：多离子吸附机制见解
Konstantinos N Maroulas,Athanasia K Tolkou,Kalliopi Ladomenou et al.
Konstantinos N Maroulas et al.
The presence of heavy metals and fluorides (F-) in wastewater poses serious environmental and public health challenges. Therefore, in this study, curcumin-doped chitosan-activated carbon (CsAC) biopolymer composites were synthesized and eva...
Sakshi S Naik,Yufei Zhao,Douglas Allan et al.
Sakshi S Naik et al.
Reversible solid oxide fuel cells (rSOCs) offer the flexibility to operate in tandem with the electric grid by switching between fuel cell and electrolysis modes based on real-time electricity prices. However, their complex, tightly coupled...
A Framework for Implementation of Dynamic Discrepancy Reduced-Order Modeling in Advanced Process Control [0.03%]
动态差异削减降阶模型在先进过程控制中的实现框架
San Dinh,Claudemi A Nascimento,David S Mebane et al.
San Dinh et al.
This paper introduces a novel framework for implementing dynamic discrepancy reduced-order modeling in advanced process control. This framework balances computational complexity and model accuracy by constructing a gray-box model that combi...
Modeling Extreme Rapid Thermal Processing in Chemical Vapor Deposition Reactors for Catalytic Growth of Carbon Nanotubes [0.03%]
用于碳纳米管催化生长的化学气相沉积反应器中极端快速热加工的建模研究
Julia Aurenzi,Moataz Abdulhafez,Golnaz Najaf Tomaraei et al.
Julia Aurenzi et al.
Chemical vapor deposition (CVD) reactors with rapid thermal processing (RTP) capabilities provide unique advantages for controlling nanomaterial synthesis. Hence, understanding the dynamics and spatial distribution of the temperature inside...
Microwave-Driven Nonoxidative and Selective Conversion of Methane to Ethylene over Mn-Based Catalysts [0.03%]
基于锰的催化剂上甲烷的选择性非氧化制乙烯的微波驱动转化反应
Snehitha Reddy Baddam,Changle Jiang,Manohar Reddy Poreddy et al.
Snehitha Reddy Baddam et al.
Recent advancements in microwave-driven nonoxidative catalytic synthesis of C2H4 from CH4 coupling offer a promising, energy-efficient, and eco-friendly alternative to conventional methods, where selective heating under microwave irradiatio...