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Experimental Validation of Calculated Atomic Charges in Ionic Liquids

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Figure

Figure 1.  Structures and abbreviations for all ions (except Cl�) used in this study.
Figure 2.  a) XPS N 1s core�level spectra and b) NEXAFS N 1s spectra for all ILs studied
Table 1.  Calculated q(N) from ion pair (GP) calculations for the three different q(N) assignment methods, N 1s
Figure 3.  Average q(N) values for all ions studied from ion pair (GP) calculations. * is used to distinguish
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