crystal orbital overlap population
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scholarly journals Origins of contrasting copper coordination geometries in crystalline copper sulfate pentahydrate

2015 ◽  
Vol 17 (46) ◽  
pp. 31023-31029 ◽  
Author(s):  
Michael T. Ruggiero ◽  
Alessandro Erba ◽  
Roberto Orlando ◽  
Timothy M. Korter
Keyword(s):  
Copper Sulfate ◽  
Population Analyses ◽  
Sulfate Pentahydrate ◽  
Crystal Orbital ◽  
Copper Sulfate Pentahydrate ◽  
Overlap Population ◽  
Copper Coordination ◽  
Crystal Orbital Overlap Population ◽  
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Crystal orbital overlap population and crystal orbital Hamiltonian population analyses provide insight into the differing water coordination geometries found in crystalline copper(ii) sulfate pentahydrate.

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