Esta edición ISBN ya no está disponible.Ver todas las copias de esta edición ISBN.
Computational Materials Science: An Introduction covers the essentials of computational science and explains how computational tools and techniques work to help solve materials science problems. The book focuses on two levels of a materials system: the electronic structure level of nuclei and electrons and the atomistic/molecular level. It presents computational treatments of these system levels using molecular dynamics (MD) and first-principles methods, since they are most relevant in materials science and engineering.
After a general overview of computational science, the text introduces MD methods based on classical mechanics and covers their implementation with run examples of XMD and LAMMPS. The author discusses first-principles methods based on quantum mechanics at an introductory level, using illustrations and analogies to assist students in understanding this difficult subject. The book then describes the density functional theory (DFT)―the first-principles method that can handle materials practically. It also reveals how each orbital of electron leads to particular properties of solids, such as total energy, band structure, and barrier energy. The final chapter implements the DFT into actual calculations with various run examples via the VASP program.
Computational methods are contributing more than ever to the development of advanced materials and new applications. For students and newcomers to computational science, this text shows how computational science can be used as a tool for solving materials problems. Further reading sections provide students with more advanced references.Biografía del autor:
June Gunn Lee is an emeritus research fellow in the Computational Science Center at the Korea Institute of Science and Technology, where he has worked for 28 years. He has published roughly 70 papers on engineering ceramics and computational materials science. He earned a Ph.D. in materials science and engineering from the University of Utah.
"Sobre este título" puede pertenecer a otra edición de este libro.
Descripción Softcover. Condición: New. 1st edition. Brand NEW, Paperback International Edition. Black & White or color, Cover and ISBN same with similar contents as US editions. Standard delivery takes 5-9 business days by USPS/DHL with tracking number. Choose expedited shipping for superfast delivery 3-5 business days by UPS/DHL/FEDEX. We also ship to PO Box addresses but by Standard delivery and shipping charges will be extra. International Edition Textbooks may bear a label -Not for sale in the U.S. or Canada- etc. printed only to discourage U.S. students from obtaining an affordable copy. Legal to use despite any disclaimer on cover as per US court. No access code or CD included unless specified. In some instances, the international textbooks may have different exercises at the end of the chapters. Printed in English. We may ship the books from multiple warehouses across the globe, including India depending upon the availability of inventory storage. In case of orders from Europe, custom charges may comply by the relevant government authority and we are not liable for it. 100% Customer satisfaction guaranteed! Please feel free to contact us for any queries. Nº de ref. del artículo: AB1517870
Descripción Crc Press, India, 2015. Hardcover. Condición: Brand New. Book Condition:- Brand New. Secured Packaging. Fast DeliveryBookseller Inventory # STM-9781439836163. book. Nº de ref. del artículo: STM-9781439836163
Descripción Paperback. Condición: New. New, Softcover International Edition, Printed in Black and White, Different ISBN, Same Content As US edition, Book Cover may be Different, in English Language. Nº de ref. del artículo: 27725
Descripción Crc Press, 2015. N.A. Condición: New. Nº de ref. del artículo: 526962
Descripción Condición: Brand New. Brand New Paperback International Edition, Perfect Condition. Printed in English. Excellent Quality, Service and customer satisfaction guaranteed!. Nº de ref. del artículo: AIND-51679
Descripción CRC Press, 2011. Condición: New. book. Nº de ref. del artículo: M1439836167
Descripción Condición: New. Brand New Paperback International Edition.We Ship to PO BOX Address also. EXPEDITED shipping option also available for faster delivery.This item may ship fro the US or other locations in India depending on your location and availability. Nº de ref. del artículo: AUSBNEW-51679
Descripción Condición: New. This is Brand NEW. Nº de ref. del artículo: Star-13082018-22139
Descripción CRC Press, 2011. Hardcover. Condición: New. Brand New!. Nº de ref. del artículo: VIB1439836167
Descripción CRC Press. Hardcover. Condición: New. 1439836167 New Condition. Nº de ref. del artículo: NEW7.0608045