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The adsorption of single water molecule on external surfaces of KDP crystal was theoretically investigated based on DFT method. We would also be grateful if you could change the image to the attached one.

DFT study of single water molecule adsorption on the (100) and (101) surfaces of KH2PO4

DFT study of single water molecule adsorption on the (100) and (101) surfaces of KH₂PO₄