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Solid electrolytes based on Na3PO4:M2+ (M=Mg, Zn, Ca, Sr)

✍ Scribed by J.T.S. Irvine; A.R. West


Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
365 KB
Volume
37
Category
Article
ISSN
0167-2738

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The PESP Parameterized ElectroStatic P otential method for calculating molecular electrostatic potentials, previously parameterized for H, C, N, O, F, P, S, Cl, and Br, is extended to molecules containing Li q , Na q , Mg 2q , K q , Ca 2q , Zn 2q , and I. For a collection of 166 molecules containing