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- W2076121337 abstract "The 29Si chemical shifts of silicon hydrides and fluorosilanes were calculated by means of the FPT method within the CNDO/2 framework. It was found that, by a small revision of the formula for the off-diagonal elements of the core Hamiltonian matrix in the CNDO/2 method, the calculated results agree well with the gross trend of the experimental values of the 29Si chemical shifts in the literature. Further, the relationship between the 29Si chemical shift and the electronic structure was discussed." @default.
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- W2076121337 date "1987-09-01" @default.
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- W2076121337 title "Silicon-29 NMR Chemical Shifts of Organosilicons as Studied by the FPT CNDO/2 Method" @default.
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- W2076121337 doi "https://doi.org/10.1246/bcsj.60.3125" @default.
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