Futing Xia

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The alkaline hydrolysis reaction of ethylene phosphate (EP) has been investigated using a supermolecule model, in which several explicit water molecules are included. The structures and single-point energies for all of the stationary points are calculated in the gas phase and in solution at the B3LYP/6-31++G(df,p) and MP2/6-311++G(df,2p) levels. The effect(More)
Normal ferroelectric poly(vinylidene fluoride-trifluoroethylene) [P(VDF-TrFE)] copolymer have been converted into relaxor ferroelectrics by introducing appropriate amount of defects into the original polar crystallites, which is achieved either by high-energy electron irradiation or by copolymerizing with a third bulky monomer 1,1-chlorofluoroethylene(More)
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