Advances in Inorganic Chemistry - Theoretical and Computational Inorganic Chemistry
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9780123808745
Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Inner- and Outer-Sphere Hydrogenation Mechanisms: A Computational Perspective

2010 ◽  
pp. 231-260 ◽  
Author(s):  
Aleix Comas-Vives ◽  
Gregori Ujaque ◽  
Agustí Lledós
Keyword(s):  
Outer Sphere ◽  
Computational Perspective

Simulations of Liquids and Solutions Based on Quantum Mechanical Forces

2010 ◽  
pp. 143-175 ◽  
Author(s):  
Thomas S. Hofer ◽  
Bernd M. Rode ◽  
Andreas B. Pribil ◽  
Bernhard R. Randolf
Keyword(s):  
Quantum Mechanical ◽  
Mechanical Forces

Spin Interactions in Cluster Chemistry

2010 ◽  
pp. 177-230 ◽  
Author(s):  
Maren Podewitz ◽  
Markus Reiher
Keyword(s):  
Cluster Chemistry ◽  
Spin Interactions
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