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Computational Methods in Lanthanide and Actinide Chemistry

2015-02-17 Science
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Release : 2015-02-17
Genre : Science
Kind : eBook
Book Rating : 287/5 ( reviews)

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Book Synopsis Computational Methods in Lanthanide and Actinide Chemistry by : Michael Dolg

Download or read book Computational Methods in Lanthanide and Actinide Chemistry written by Michael Dolg. This book was released on 2015-02-17. Available in PDF, EPUB and Kindle. Book excerpt: The f-elements and their compounds often possess an unusually complex electronic structure, governed by the high number of electronic states arising from open f-shells as well as large relativistic and electron correlation effects. A correct theoretical description of these elements poses the highest challenges to theory. Computational Methods in Lanthanide and Actinide Chemistry summarizes state-of-the-art electronic structure methods applicable for quantum chemical calculations of lanthanide and actinide systems and presents a broad overview of their most recent applications to atoms, molecules and solids. The book contains sixteen chapters, written by leading experts in method development as well as in theoretical investigations of f-element systems. Topics covered include: Relativistic configuration interaction calculations for lanthanide and actinide anions Study of actinides by relativistic coupled cluster methods Relativistic all-electron approaches to the study of f- element chemistry Relativistic pseudopotentials and their applications Gaussian basis sets for lanthanide and actinide elements Applied computational actinide chemistry This book will serve as a comprehensive reference work for quantum chemists and computational chemists, both those already working in, and those planning to enter the field of quantum chemistry for f-elements. Experimentalists will also find important information concerning the capabilities of modern quantum chemical methods to assist in the interpretation or even to predict the outcome of their experiments.

Computational Methods in Lanthanide and Actinide Chemistry

2015 SCIENCE
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Author :
Release : 2015
Genre : SCIENCE
Kind : eBook
Book Rating : 304/5 ( reviews)

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Book Synopsis Computational Methods in Lanthanide and Actinide Chemistry by : Michael Dolg

Download or read book Computational Methods in Lanthanide and Actinide Chemistry written by Michael Dolg. This book was released on 2015. Available in PDF, EPUB and Kindle. Book excerpt:

Experimental and Theoretical Approaches to Actinide Chemistry

2018-03-19 Science
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Release : 2018-03-19
Genre : Science
Kind : eBook
Book Rating : 523/5 ( reviews)

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Book Synopsis Experimental and Theoretical Approaches to Actinide Chemistry by : John K. Gibson

Download or read book Experimental and Theoretical Approaches to Actinide Chemistry written by John K. Gibson. This book was released on 2018-03-19. Available in PDF, EPUB and Kindle. Book excerpt: A review of contemporary actinide research that focuses on new advances in experiment and theory, and the interplay between these two realms Experimental and Theoretical Approaches to Actinide Chemistry offers a comprehensive review of the key aspects of actinide research. Written by noted experts in the field, the text includes information on new advances in experiment and theory and reveals the interplay between these two realms. The authors offer a multidisciplinary and multimodal approach to the nature of actinide chemistry, and explore the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry. The text covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques. The authors provide contemporary overviews of each topic area presented and describe the current and anticipated experimental approaches for the field, as well as the current and future computational chemistry and materials techniques. In addition, the authors explore the combination of experiment and theory. This important resource: Provides an essential resource the reviews the key aspects of contemporary actinide research Includes information on new advances in experiment and theory, and the interplay between the two Covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques Focuses on the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry Written for academics, students, professionals and researchers, this vital text contains a thorough review of the key aspects of actinide research and explores the most recent advances in experiment and theory.

Handbook on the Physics and Chemistry of Rare Earths

2016-10-31 Science
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Release : 2016-10-31
Genre : Science
Kind : eBook
Book Rating : 520/5 ( reviews)

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Book Synopsis Handbook on the Physics and Chemistry of Rare Earths by :

Download or read book Handbook on the Physics and Chemistry of Rare Earths written by . This book was released on 2016-10-31. Available in PDF, EPUB and Kindle. Book excerpt: Handbook on the Physics and Chemistry of Rare Earths: Including Actinides is a continuous series of books covering all aspects of rare earth science, including chemistry, life sciences, materials science, and physics. The book's main emphasis is on rare earth elements [Sc, Y, and the lanthanides (La through Lu], but whenever relevant, information is also included on the closely related actinide elements. Individual chapters are comprehensive, broad, up-to-date, critical reviews written by highly experienced, invited experts. The series, which was started in 1978 by Professor Karl A. Gschneidner Jr., combines, and integrates, both the fundamentals and applications of these elements with two published volumes each year. Presents up-to-date overviews and new developments in the field of rare earths, covering both their physics and chemistry Contains Individual chapters that are comprehensive and broad, with critical reviews Provides contributions from highly experienced, invited experts

Experimental and Theoretical Approaches to Actinide Chemistry

2018-01-08 Science
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Author :
Release : 2018-01-08
Genre : Science
Kind : eBook
Book Rating : 54X/5 ( reviews)

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Book Synopsis Experimental and Theoretical Approaches to Actinide Chemistry by : John K. Gibson

Download or read book Experimental and Theoretical Approaches to Actinide Chemistry written by John K. Gibson. This book was released on 2018-01-08. Available in PDF, EPUB and Kindle. Book excerpt: A review of contemporary actinide research that focuses on new advances in experiment and theory, and the interplay between these two realms Experimental and Theoretical Approaches to Actinide Chemistry offers a comprehensive review of the key aspects of actinide research. Written by noted experts in the field, the text includes information on new advances in experiment and theory and reveals the interplay between these two realms. The authors offer a multidisciplinary and multimodal approach to the nature of actinide chemistry, and explore the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry. The text covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques. The authors provide contemporary overviews of each topic area presented and describe the current and anticipated experimental approaches for the field, as well as the current and future computational chemistry and materials techniques. In addition, the authors explore the combination of experiment and theory. This important resource: Provides an essential resource the reviews the key aspects of contemporary actinide research Includes information on new advances in experiment and theory, and the interplay between the two Covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques Focuses on the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry Written for academics, students, professionals and researchers, this vital text contains a thorough review of the key aspects of actinide research and explores the most recent advances in experiment and theory.

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