Analysis of difference two-electron density matrix between two states of magnetic molecules
Author:
Publisher
Wiley
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics
Reference14 articles.
1. Quantum Theory of Many-Particle Systems. I. Physical Interpretations by Means of Density Matrices, Natural Spin-Orbitals, and Convergence Problems in the Method of Configurational Interaction
2. Open- and closed-shell states in few-particle quantum mechanics. I. Definitions
3. Radial Electron–Electron Distributions and the Coulomb Hole for Be
4. Charge densities and two-electron intracules for the low-lying excited states of the helium-like ions
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