Time-dependent Density Functional Results for the Dynamic Hyperpolarizability ofC60
نویسندگان
چکیده
منابع مشابه
Time - dependent density functional study of the static second hyperpolarizability of BB - , NN - and BN - substituted C 60
In this work we have investigated the effects of substituting carbon atoms with B and N on the second hyperpolarizability of C60 using time-dependent density functional theory. We have calculated the second hyperpolarizability of the double substitute-doped fullerenes C58NN, C58BB and C58BN. For C60 only small changes in the second hyperpolarizability were found when doping with either 2B or 2N...
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ژورنال
عنوان ژورنال: Physical Review Letters
سال: 1997
ISSN: 0031-9007,1079-7114
DOI: 10.1103/physrevlett.78.3097