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RSS Feeds[ASAP] Capturing Deuteration Effects in a Molecular Mechanics Force Field: Deuterated THF and the THF-Water Miscibility Gap (Journal of Chemical Theory and Computation)

 
 

26 march 2020 18:00:34

 
[ASAP] Capturing Deuteration Effects in a Molecular Mechanics Force Field: Deuterated THF and the THF-Water Miscibility Gap (Journal of Chemical Theory and Computation)
 


Journal of Chemical Theory and ComputationDOI: 10.1021/acs.jctc.9b01138


 
190 viewsCategory: Chemistry
 
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[ASAP] A Computational Assessment of Actinide Dioxide Cations AnO22+ for An = U to Lr: The Limited Stability Range of the Hexavalent Actinyl Moiety, [O-An-O]2+ (Inorganic Chemistry)
 
 
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