Cagelike Clusters as Models for the Isolated Hydroxyls of Silica: Ab Initio B3-LYP Calculations of the Interaction with Ammonia
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Axel D. Becke
Chengteh Lee, Weitao Yang, Robert G. Parr
Thom H. Dunning
S.F. Boys, F. Bernardi
Curt M. Breneman, Kenneth B. Wiberg
Evgenii A Paukshtis, E N Yurchenko
Evgenii A Paukshtis, E N Yurchenko
Albert Rimola, Mariona Sodupe · 2007
- Published
- Apr 08, 1999
- Vol/Issue
- 15(18)
- Pages
- 5829-5835
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