Quantum chemical study of regular and irregular geometries of MgO nanoclusters: Effects on magnetizability, electronic properties and physical characteristics

2017 ◽  
Vol 199 ◽  
pp. 7-17 ◽  
Author(s):  
Sergio Manzetti ◽  
Alexei Yakovlev
Keyword(s):  
Electronic Properties ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Physical Characteristics ◽  
Irregular Geometries

Electronic Properties of Neutral Dyes in the Channels of Zeolite L:  A Combined Spectroscopic and Quantum Chemical Study

2007 ◽  
Vol 111 (1) ◽  
pp. 8-15 ◽  
Author(s):  
Beate Bussemer ◽  
Dirk Munsel ◽  
Heike Wünscher ◽  
Gerhard J. Mohr ◽  
Ulrich-Walter Grummt
Keyword(s):  
Electronic Properties ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Zeolite L
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