CERES: An ab initio code dedicated to the calculation of the electronic structure and magnetic properties of lanthanide complexes
Author:
Affiliation:
1. School of ChemistryUniversity of Melbourne Victoria3010 Australia
Funder
Australian Research Council
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.25113
Reference66 articles.
1. Lanthanides in magnetic resonance imaging
2. Lanthanide Single-Molecule Magnets
3. Molecular Nanomagnets
4. A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach
5. The complete active space SCF (CASSCF) method in a Newton–Raphson formulation with application to the HNO molecule
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