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RSS FeedsRobust, Basis-Set Independent Method for the Evaluation of Charge-Transfer Energy in Noncovalent Complexes (Journal of Chemical Theory and Computation)

 
 

27 january 2015 02:07:31

 
Robust, Basis-Set Independent Method for the Evaluation of Charge-Transfer Energy in Noncovalent Complexes (Journal of Chemical Theory and Computation)
 


Journal of Chemical Theory and ComputationDOI: 10.1021/ct501115m


 
162 viewsCategory: Chemistry
 
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First-Principles Insight into the Hydration Ability and Proton Conduction of the Solid State Proton Conductor, Y and Sn Co-Doped BaZrO3 (Chemistry of Materials)
 
 
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