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Electron density distribution as a parameter in understanding organic cation exchange in montmorillonite

✍ Scribed by André Maes; Leo Van Leemput; Adrien Cremers; Jan Uytterhoeven

Publisher
Elsevier Science
Year
1980
Tongue
English
Weight
467 KB
Volume
77
Category
Article
ISSN
0021-9797

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📜 SIMILAR VOLUMES

Electron spin density distribution in th
Electron spin density distribution in the CO+, CO2− and O2− radicals as a function of geometry
✍ D.P. Vercauteren; J.-M. André; E.G. Derouane 📂 Article 📅 1975 🏛 Elsevier Science 🌐 English ⚖ 440 KB

The standard INDC method has been used to calculate the e!cctron spin density distribution and isotropic Fermi contact hypcrfine coupling in the radicals CO+, COT, and OF. Bond lengths and angle (for CO?:) have been varied over a rcasonable ranpe. Geomctricnl effects arc found to have a rclativcly s