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Anharmonic, Temperature, and Matrix Effects on the Molecular Structure and Vibrational Frequencies of Lanthanide Trihalides LnX 3 (Ln = La, Lu; X = F, Cl)

✍ Scribed by Lanza, Giuseppe; Minichino, Camilla


Book ID
120468394
Publisher
American Chemical Society
Year
2005
Tongue
English
Weight
316 KB
Volume
109
Category
Article
ISSN
1089-5639

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πŸ“œ SIMILAR VOLUMES


A relativistic effective core potential
✍ Giuseppe Lanza; Ignazio L. FragalΓ  πŸ“‚ Article πŸ“… 1996 πŸ› Elsevier Science 🌐 English βš– 467 KB

The equilibrium geometries and harmonic vibrational frequencies of some lanthanide trihalides LnX 3 (Ln ~ Gd, Lu; X -= F, CI) have been investigated using ab initio relativistic effective core potential Hartree-Fock, complete active space multiconfigurationai self-consistent field and second-order M