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SCF [self-consistent field]-X.alpha. scattered wave calculation of the electronic structure of dioxygenbis(phosphine)platinum

✍ Scribed by Norman, J. G.


Book ID
127302368
Publisher
American Chemical Society
Year
1974
Tongue
English
Weight
266 KB
Volume
96
Category
Article
ISSN
0002-7863

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📜 SIMILAR VOLUMES


Calculation of the electronic structure
✍ I.P. Batra; O. Robaux 📂 Article 📅 1974 🏛 Elsevier Science 🌐 English ⚖ 308 KB

It Ius recently been established that physiul realism of the resu!ts can be irnprov-d within the framework of the self-consistent statist&l exctiange multiple scattering wave method if the atomic spheres are allowed to overkp. Here we report that by semi-empirically adjust% the overlap of the atomic