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Full-Potential Electronic Structure Method
Wills, John M.; Alouani, Mebarek; Andersson, Per; Delin, Anna; Eriksson, Olle; Grechnyev, Oleksiy
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Description for Full-Potential Electronic Structure Method
Paperback. This book covers the theory of electronic structure of materials, emphasizing usage of linear muffin-tin orbitals. Covers local spin density approximation, generalised gradient approximation, self-interaction correction and dynamical mean field theory. Series: Springer Series in Solid-State Sciences. Num Pages: 200 pages, biography. BIC Classification: PHF; PHU. Category: (P) Professional & Vocational. Dimension: 235 x 155 x 11. Weight in Grams: 332.
This is a book describing electronic structure theory and application within the framework of a methodology implemented in the computer code RSPt. In 1986, when the code that was to become RSPt was developed enough to be useful, it was one of the ?rst full-potential, all-electron, relativistic implem- tations of DFT (density functional theory). While RSPt was documented p- asitically in many publications describing the results of its application, it was many years before a publication explicitly describing aspects of the method appeared. In the meantime, several excellent all-electron, full-potential me- ods had been developed, published, and become available. So ... Read more
This is a book describing electronic structure theory and application within the framework of a methodology implemented in the computer code RSPt. In 1986, when the code that was to become RSPt was developed enough to be useful, it was one of the ?rst full-potential, all-electron, relativistic implem- tations of DFT (density functional theory). While RSPt was documented p- asitically in many publications describing the results of its application, it was many years before a publication explicitly describing aspects of the method appeared. In the meantime, several excellent all-electron, full-potential me- ods had been developed, published, and become available. So ... Read more
Product Details
Format
Paperback
Publication date
2013
Publisher
Springer-Verlag Berlin and Heidelberg GmbH & Co. KG Germany
Number of pages
200
Condition
New
Series
Springer Series in Solid-State Sciences
Number of Pages
200
Place of Publication
Berlin, Germany
ISBN
9783642266249
SKU
V9783642266249
Shipping Time
Usually ships in 15 to 20 working days
Ref
99-15
About Wills, John M.; Alouani, Mebarek; Andersson, Per; Delin, Anna; Eriksson, Olle; Grechnyev, Oleksiy
John Wills is a Technical Staff Member in the Theoretical Division at Los Alamos National Laboratory, current serving as Group Leader of the Physics and Chemistry of Materials Group. He has worked on electronic structure theory and application for the past 27 years, and is an author on 170 publications in this area, 61 of which are on the electronic ... Read more
Reviews for Full-Potential Electronic Structure Method
From the reviews: “The book describes the electron structure theory and its applications within the implementation by using the computer code for relativistic spin-polarized tests (RSPt). … the book presents a very interesting attempt to create a powerful electronic database of physical properties … . may be useful to students, post-graduate students, their teachers and researchers working in modern ... Read more