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Computational analysis of crystal field parameters of rare-earth transition-metal compounds

✍ Scribed by Manuel Richter; Peter M. Oppeneer; Helmut Eschrig; Börje Johansson


Publisher
Elsevier Science
Year
1993
Tongue
English
Weight
235 KB
Volume
186-188
Category
Article
ISSN
0921-4526

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Crystal field strength: Angular overlap
✍ M. Faucher; D. Garcia; C.K. Jørgensen 📂 Article 📅 1986 🏛 Elsevier Science 🌐 English ⚖ 390 KB

An expression for the crystal field strength is defined in terms of one-electron energies and crystal field parameters. The relative contribution of kinetic energy and Coulombic interaction in ligand field effects is analyzed. The angular overlap model is applied to 11 rareearth or rareearthdoped co