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An application of schoonschip for algebraic calculations in quantum chemistry

✍ Scribed by P.-O. Nerbrant


Publisher
Elsevier Science
Year
1978
Tongue
English
Weight
286 KB
Volume
14
Category
Article
ISSN
0010-4655

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✦ Synopsis


The program SCHOONSCHIP is used to evaluate fermion expectation values in quantum chemistry. Some remarks are made from experiences with the program.


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Quantum mechanics of pseudorotation in r
✍ Carl Trindle πŸ“‚ Article πŸ“… 1988 πŸ› John Wiley and Sons 🌐 English βš– 582 KB

A variety of quantum mechanical models have guided the interpretation of the far infrared (IR) spectrum of easily deformed ring systems, but an explicit guide to such modelling would ease further analysis. The coordinates introduced by Cremer and Pople provide a starting point for description of puc