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The calculation of ligand-field multiplet states from multiple-scattering Xα wave functions

✍ Scribed by C. Daul; A. Goursot

Publisher
John Wiley and Sons
Year
1986
Tongue
English
Weight
551 KB
Volume
29
Category
Article
ISSN
0020-7608

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Ligand field transitions in PtCl2−4 calc
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✍ R.P. Messmer; U. Wahlgren; K.H. Johnson 📂 Article 📅 1973 🏛 Elsevier Science 🌐 English ⚖ 328 KB

The SCF Xa SW method can be used to obtain uniquely all the multiplets arising from the did transitions in the square planar metal complex PtCI\*-4 . The agreement with the expcrimcntzl absorption spectrum and the singlet transition assignments in the region = 3.0-4.5 eV is exccllcnt.