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José Manuel Domínguez-Esquivel Manuel Ramos Editors Advanced Catalytic Materials: Current Status and Future Progress Advanced Catalytic Materials: Current Status and Future Progress . José Manuel Domínguez-Esquivel Manuel Ramos Editors Advanced Catalytic Materials: Current Status and Future Progress Editors José Manuel Domínguez-Esquivel Manuel Ramos Dirección de Investigación Departamento de Física y Matemáticas Instituto Mexicano del Petróleo Universidad Autonoma de Ciudad Juárez Mexico City, Mexico Ciudad Juárez, Chihuahua-México, Mexico ISBN 978-3-030-25991-4 ISBN 978-3-030-25993-8 (eBook) https://doi.org/10.1007/978-3-030-25993-8 © Springer Nature Switzerland AG 2019 This work is subject to copyright. All rights are reserved by the Publisher, whether the whole or part of the material is concerned, specifically the rights of translation, reprinting, reuse of illustrations, recitation, broadcasting, reproduction on microfilms or in any other physical way, and transmission or information storage and retrieval, electronic adaptation, computer software, or by similar or dissimilar methodology now known or hereafter developed. The use of general descriptive names, registered names, trademarks, service marks, etc. in this publication does not imply, even in the absence of a specific statement, that such names are exempt from the relevant protective laws and regulations and therefore free for general use. The publisher, the authors, and the editors are safe to assume that the advice and information in this book are believed to be true and accurate at the date of publication. Neither the publisher nor the authors or the editors give a warranty, express or implied, with respect to the material contained herein or for any errors or omissions that may have been made. The publisher remains neutral with regard to jurisdictional claims in published maps and institutional affiliations. This Springer imprint is published by the registered company Springer Nature Switzerland AG The registered company address is: Gewerbestrasse 11, 6330 Cham, Switzerland Preface This book comprehends a compendium of ten chapters. Chapter 1 presents a comprehensive introduction made by Prof. Dr. Russell R. Chianelli from Materials Research and Technology Institute of the University of Texas at El Paso, covering some fundamental aspects of metallic nanoparticles, transition metal sulfides and carbides, and more related to catalytic process mainly with emphasis of energy production in low contaminant liquid fuels and an ideal approach constituted by the following steps: theory + synthesis + characterization + commercialization. Chapter 2 presents the synthesis of novel catalytic materials like titania nanotubes and tran- sition metal carbides, nitrides, and sulfides by a group from the University Federal do Ceará, Brazil, in collaboration with the Universidad Regional Amazónica (IKIAM). Chapter 3 is dedicated to computation methods using density functional theory methods to describe electronic structure and other catalytic properties mainly in transition metal sulfides with special emphasis on molybdenum disulfide (MoS ) 2 catalyst for hydroprocessing reactions. Chapter 4 corresponds to catalytic evalua- tion and performance by laboratory test under hydroprocessing conditions, mainly the effects of support over pure transition metal sulfide catalytic materials, as pre- sented by a strong research group of Chemical Engineering Faculty of the Universidad Nacional Autónoma de México at Mexico City Campus. Chapter 5 presents advanced electron microscopy methods for atomistic study of structure/ function relationships. Chapter 6 presents a novel approach developed by a group at the University of Calgary in Canada for in situ upgrading by applying nano-catalyst fluid injection at reservoir conditions. Chapter 7 presents a complete characteriza- tion of spherical shape catalytic materials with an electron tomography technique done in collaboration with Argonne National Laboratory and Instituto Mexicano del Petróleo. Chapter 8 presents the usage of ceria oxide metal doping materials for methanol reforming and water split as presented by a group from the Instituto Nacional de Investigaciones Nucleares in Mexico. Chapter 9 presents the photo- catalytic activity of titanium oxide low-dimension materials which is a work contri- bution by a group from Mechanical Engineering of the University of Houston, USA. Chapter 10 presents a new family of ternary phase catalytic materials for v vi Preface hydrodesulphurization reactions by a group from the Chemistry Department of the University of Texas. The book corresponds to topics that have been addressed for more than 30 years of science and experimentation on the physical and chemical study of catalytic materials, reactions, electronic structure, characterization, and methods for the development of fundamental aspects to produce low contaminant liquid fuels to supply the worldwide energy demands. We believe this book presents a strong basis for undergraduate, graduate, and early career researchers who are currently dedicated to study physical and chemical catalytic low-dimension materials and systems. In the name of all author contributors, we thank specially the Springer Nature publishers group for supporting our book proposal and for allowing us to publish this compendium of chapters. We thank all the funding agencies and academic institu- tions like the following: Consejo Nacional de Ciencia y Tecnología, México; Canada Foundation for Innovation (CFI); Institute for Sustainable Energy, Environment, and Economy (ISEEE); Schulich School of Engineering at the University of Calgary; Universidad Nacional Autónoma de México; Instituto Mexicano del Petróleo; Universidad Autónoma de Ciudad Juárez; and Instituto de Nanociencia de Aragon (INA) of the Universidad de Zaragoza in Spain. We also thank the State Key Laboratory of Coal Conversion of the Institute of Coal Chemistry funded by the Chinese Academy of Sciences, Universidad Federal do Ceará, and CNPq grant num- bers 473568/2012-8, 470793/2013-9 for their economical support, the Venezuelan Institute for Scientific Research, the Universidad Regional Amazónica IKIAM at Ecuador, the University of Houston, the University of Texas at El Paso, Argonne National Laboratory, and the Instituto Nacional de Investigaciones Nucleares. The compilation of this book was part of a research project funded by the Mexican Science Council [CONACyT-México] under solicitation grant #177077 for SENER- hydrocarbons administrated by Instituto Mexicano del Petróleo with internal register #Y.61006. Finally, we thank the reader for the interest in this scientific written material, and we hope to achieve a positive impact on their specific research activities. Ciudad de México, Mexico José Manuel Domínguez-Esquivel Chihuahua, Mexico Manuel Ramos Contents 1 One Brief Introduction to Catalytic Materials . . . . . . . . . . . . . . . . . . . 1 Russell R. Chianelli 2 Synthesis of Novel Catalytic Materials: Titania Nanotubes and Transition Metal Carbides, Nitrides, and Sulfides . . . . . . . . . . . . 13 Davi Coelho de Carvalho, Josue Mendes Filho, Odair Pastor Ferreira, Alcineia Conceição Oliveira, Elisabete Moreira Assaf, and Yanet Villasana 3 Theoretical Insights into the Electronic Structure and Catalytic Activity on MoS- Based Catalyst . . . . . . . . . . . . . . . . . . 41 2 Xiaodong Wen, Tao Yang, Manuel Ramos, Gabriel A. Gonzalez, and Russell R. Chianelli 4 C atalytic Materials for Hydrodesulfurization Processes, Experimental Strategies to Improve Their Performance . . . . . . . . . . 61 Jorge Ramírez, Perla Castillo-Villalón, Aída Gutiérrez-Alejandre, Rogelio Cuevas, and Aline Villarreal 5 E lectron Microscopy Techniques to Study Structure/Function Relationships in Catalytic Materials . . . . . . . . . . . . . . . . . . . . . . . . . . . 97 Álvaro Mayoral, Paz del Angel, and Manuel Ramos 6 I n Situ Upgrading via Hot Fluid and Nanocatalyst Injection . . . . . . . 129 Carlos E. Scott, Lante Carbognani-Ortega, and Pedro Pereira-Almao 7 P orosity and Fractality of MoS and MoS/Co-catalytic 2 2 Spheres . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 151 Félix Galindo-Hernández, Ilke Arslan, José Manuel Domínguez, and Manuel Ramos vii viii Contents 8 Catalytic Ni/CeO Nanorods and Ag/CeO Nanotubes 2 2 for Hydrogen Production by Methanol Reforming . . . . . . . . . . . . . . . 167 Raúl Pérez-Hernández 9 E ffective Visible Light Photodegradation of Paraoxon with Pure and Doped TiO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 191 2 A. K. P. D. Savio, J. Fletcher, K. Smith, R. Iyer, J. Bao, and F. C. Robles Hernández 10 Ternary-Phase NiMoWS Catalytic Material 2 for Hydrodesulfurization . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 209 Brenda Torres, Lorena Alvarez-Contreras, Daniel Bahena-Uribe, Russell R. Chianelli, and Manuel Ramos Index . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 217 Chapter 1 One Brief Introduction to Catalytic Materials Russell R. Chianelli The field of catalysis is an ancient scientific art practice that dates back centuries to this day, as well described by Wismiak [1]. It was the need for ammunition in WWI and the need for trucks, tanks, and aircraft that accelerated the development of mod- ern catalytic technologies. Catalysis plays a fundamental role in petroleum refining and basic petrochemical industries creating new routes in the development of indus- trial processes [2]. Moreover, catalysis has become indispensable to the solution of environmental pollution problems and therefore a positive impact on public health [3]. Worldwide concerns for preservation of the environment have motivated the development of “green” energy production in which the catalytic world plays an important role on those catalyst-based technologies, by achieving a better utilization of petroleum resources, to produce cleaner liquid fuels and derivatives to supply the enormous demand for commercial and public transportation [4]; the latter has caused great environmental concerns to make severe regulations mainly to lower sulfur, nitrogen, and aromatic content in commercial liquid fuels, to achieve better air quality mainly in large populated areas such as Shanghai, Mexico City, New York, London, Frankfurt, Paris, and São Paulo among other large urban areas [5, 6]. Heterogeneous catalysts currently come in three forms: metals, oxides, and sulfides. However, oxides and carbides are currently under study for similar catalytic pur- poses and processes in novel applications [7–9]. The study of heterogeneous catalytic materials involves a multidisciplinary approach: Theory+Synthesis+Characterization+Commercialization R. R. Chianelli (*) Materials Research and Technology Institute, University of Texas at El Paso, 500W University Ave. Physical Science Building 201A, El Paso, TX, USA e-mail: [email protected] © Springer Nature Switzerland AG 2019 1 J. M. Domínguez-Esquivel, M. Ramos (eds.), Advanced Catalytic Materials: Current Status and Future Progress, https://doi.org/10.1007/978-3-030-25993-8_1

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