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Dyall K G, Fægri K, Jr.: Introduction to Relativistic Quantum Chemistry

✍ Scribed by Christopher J. Cramer


Book ID
105886178
Publisher
Springer
Year
2007
Tongue
English
Weight
66 KB
Volume
119
Category
Article
ISSN
1432-2234

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📜 SIMILAR VOLUMES


Introduction to relativistic quantum che
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This book provides an introduction to the essentials of relativistic effects in quantum chemistry, and a reference work that collects all the major developments in this field. It is designed for the graduate student and the computational chemist with a good background in nonrelativistic theory. In a

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We suggest a simple procedure which nukes it posslblc to include relatititlc effects npproximately in variational LCAO calculations. The scheme uses a free-particle projection, and is readily apphcabIe to polyatomic systems Pilot cdlculatlons on one-electron atoms are presented, and compared with ex