We studied the transferability of the localized orbitals (LOs) of interacting Ne atoms using several basis sets. Both at SCF and at MP2 and MP3 levels, the contributions of the LOs have been calculated and discussed for the Nez and Ne, systems. It was shown that for the LOs the transferability is s
β¦ LIBER β¦
A procedure for the calculation of the electrochemical interaction energy between dissimilar amphoteric surfaces
β Scribed by Aamir Husain
- Publisher
- Elsevier Science
- Year
- 1983
- Tongue
- English
- Weight
- 558 KB
- Volume
- 93
- Category
- Article
- ISSN
- 0021-9797
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