Advances in quantum chemistry. Vol. 51 /

Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field that falls between the historically established areas of mathematics, physics, chemistry, and biology. With invited reviews written by leading international researchers, each presenting new result...

Πλήρης περιγραφή

Λεπτομέρειες βιβλιογραφικής εγγραφής
Άλλοι συγγραφείς: Sabin, John R., Brändas, Erkki, Löwdin, Per-Olov, 1916-2000
Μορφή: Ηλ. βιβλίο
Γλώσσα:English
Έκδοση: Amsterdam : Academic Press, 2006.
Έκδοση:1st ed.
Σειρά:Advances in quantum chemistry ; v. 51.
Θέματα:
Διαθέσιμο Online:Full Text via HEAL-Link
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245 0 0 |a Advances in quantum chemistry.  |n Vol. 51 /  |c editors, John R. Sabin, Erkki Brändas ; founding editor, Per-Olov Löwdin. 
250 |a 1st ed. 
260 |a Amsterdam :  |b Academic Press,  |c 2006. 
300 |a 1 online resource (x, 322 pages) :  |b illustrations. 
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490 1 |a Advances in quantum chemistry,  |x 0065-3276 ;  |v v. 51 
504 |a Includes bibliographical references and index. 
588 0 |a Print version record. 
520 |a Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field that falls between the historically established areas of mathematics, physics, chemistry, and biology. With invited reviews written by leading international researchers, each presenting new results, it provides a single vehicle for following progress in this interdisciplinary area. Advances in Quantum Chemistry, Volume 51 deals with various aspects of mathematical versus chemical applications. Some parts belong to established scientific domains, where technical progress has been crucial for the development of modern quantum chemistry as well as the quantification problem in spectral resonance analysis. The first chapter in the volume, concerns the calculation of molecular electronic structure to high accuracy, using a variety of one and two-body schemes in the coupled cluster family of methods. Chapter 2 is devoted to Angular Momentum Diagrams. In chapters 3 and 4, the autors portray Chemical Graph Theory (CGT). Advances quantum mechanical signal processing through the fast Pad & eacute; transform (FPT) are covered in Chapter 5. The concluding chapter gives a mathematical view of molecular equilibria using a Density-Functional Theory (DFT) description. * Publishes articles, invited reviews and proceedings of major international conferences and workshops * Compiled by the leading international researchers in quantum and theoretical chemistry * Highlights the important, interdisciplinary developments. 
650 0 |a Quantum chemistry. 
650 7 |a Quantum chemistry.  |2 fast  |0 (OCoLC)fst01085086 
655 4 |a Electronic books. 
700 1 |a Sabin, John R. 
700 1 |a Brändas, Erkki. 
700 1 |a Löwdin, Per-Olov,  |d 1916-2000. 
830 0 |a Advances in quantum chemistry ;  |v v. 51. 
856 4 0 |u https://www.sciencedirect.com/science/bookseries/00653276/51  |z Full Text via HEAL-Link