Direct approximation to the reduced density matrices: Calculation of the isoelectronic sequence of beryllium up to argon
Author:
Publisher
American Physical Society (APS)
Link
http://harvest.aps.org/v2/journals/articles/10.1103/PhysRevA.33.1525/fulltext
Reference13 articles.
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4. Bopp's approximation to the energy of anN-electron system
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1. Contracting and calculating traces over the N-electron space: Two powerful tools for obtaining averages;International Journal of Quantum Chemistry;1996-10-05
2. Matrix elements of Sz-adapted and theLz-adapted reduced Hamiltonians;Journal of Molecular Structure: THEOCHEM;1995-01
3. Contraction algorithms for third-order reduced density matrices: Symmetric group approach;Journal of Mathematical Chemistry;1993
4. Matrix elements of spin-adapted reduced Hamiltonians;Physical Review A;1991-04-01
5. The Two-Electron Bond as a Molecular Building Block;The Concept of the Chemical Bond;1990
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