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- W2078360023 abstract "The thermal conductivity of neon, over a wide pressure range up to 1000 MPa, is determined from ab initio calculations. A previous published ab initio potential for Ne2 is applied in an equilibrium molecular dynamics simulation. The thermal conductivity is obtained from the Green-Kubo integral. Comparisons with experiment show that the ab initio results do not deviate by more than 10% from the experimental values, the r.m.s. deviation being only 4.3% for ten values between 100 and 1000 MPa. As no fit parameters are used, this is a quite pleasing result for the first approach of its kind." @default.
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- W2078360023 date "1992-08-10" @default.
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- W2078360023 title "<i>Ab initio</i>calculation of the thermal conductivity of neon in the liquid and hypercritical state over a wide pressure range" @default.
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- W2078360023 doi "https://doi.org/10.1080/00268979200101991" @default.
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