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A quantum-mechanical study of the (110) surface of sphalerite (ZnS) and its interaction with Pb2+species

✍ Scribed by H. M. Steele; K. Wright; I. H. Hillier

Book ID
105982784
Publisher
Springer-Verlag
Year
2003
Tongue
English
Weight
293 KB
Volume
30
Category
Article
ISSN
0342-1791

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## Abstract __Ab initio__ SCF computations indicate that the formation of an adduct of glyoxal to the guanidinium ion occurs in two steps. The first addition should occur on an NH~2~ group, rather than on NHCH~3~, and the formation of an unsymmetrical adduct IV is competitive and may be even favore