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22244472104
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μ is independent of the doping ratio
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μ is independent of the doping ratio.
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16
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0016922272
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The density of molecules was calculated from the crystal structure given in
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The density of molecules was calculated from the crystal structure given in C. H. Griffiths, M. S. Walker, and P. Goldstein, Mol. Cryst. Liq. Cryst. 33, 149 (1976).
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19
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22244473462
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-
We used the semiempirical method PM3 as implemented in HYPERCHEM™ 5.1 of HyperCube, Inc. The electron affinities were calculated as difference of the total energies of the neutral and the single negatively charged molecules within the self-consistent field approximation, using the Unrestricted Hartree-Fock scheme
-
We used the semiempirical method PM3 as implemented in HYPERCHEM™ 5.1 of HyperCube, Inc. The electron affinities were calculated as difference of the total energies of the neutral and the single negatively charged molecules within the self-consistent field approximation, using the Unrestricted Hartree-Fock scheme.
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20
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0141596652
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