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Computational Aspects for Large Chemical Systems
Enrico Clementi
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Description for Computational Aspects for Large Chemical Systems
Paperback. Series: Lecture Notes in Chemistry. Num Pages: 189 pages, 59 black & white tables, biography. BIC Classification: PNRP. Category: (P) Professional & Vocational. Dimension: 244 x 170 x 10. Weight in Grams: 348.
1. 1 STATEMENT OF THE PROBLEM Quantum chemistry judged not from the ever present possibility of unex pected developments but on the basis of the achievements in the last fifty years, is predominantly limited to attempts to solve for the energy and expectation values of wave functions representing, in the limit, an exact solution to the Schroedinger equation. Because of well-known dif ficulties in system with more than about 50 electrons, the adopted ap proximations are generally rather crude. As examples of quantum chemical approximations we mention the total or partial neglects of electron correlation, the neglect of relativistic effects, ... Read more
1. 1 STATEMENT OF THE PROBLEM Quantum chemistry judged not from the ever present possibility of unex pected developments but on the basis of the achievements in the last fifty years, is predominantly limited to attempts to solve for the energy and expectation values of wave functions representing, in the limit, an exact solution to the Schroedinger equation. Because of well-known dif ficulties in system with more than about 50 electrons, the adopted ap proximations are generally rather crude. As examples of quantum chemical approximations we mention the total or partial neglects of electron correlation, the neglect of relativistic effects, ... Read more
Product Details
Format
Paperback
Publication date
1980
Publisher
Springer-Verlag Berlin and Heidelberg GmbH & Co. KG Germany
Number of pages
189
Condition
New
Series
Lecture Notes in Chemistry
Number of Pages
184
Place of Publication
Berlin, Germany
ISBN
9783540100140
SKU
V9783540100140
Shipping Time
Usually ships in 15 to 20 working days
Ref
99-15
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