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- W2017328435 abstract "The intermolecular interaction potentials of methane $({text{CH}}_{4})$ dimer are calculated within the density functional theory in the local density approximation (LDA). It is found that the calculated potentials have minima when the intermolecular distance of ${text{CH}}_{4}$ dimer is about $7.0phantom{rule{0.3em}{0ex}}text{a.u.}$, which is in good agreement with the experiment. The depth of the potential is $0.017phantom{rule{0.3em}{0ex}}text{eV}$. The results obtained by our LDA calculations seem to agree well with those obtained by MP2, MP3, and CCSD from the Mo{}ller-Plesset and coupled cluster methods by Tsuzuki et al. and with the experimental data." @default.
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- W2017328435 date "2004-03-23" @default.
- W2017328435 modified "2023-09-26" @default.
- W2017328435 title "Intermolecular interaction potentials of the methane dimer from the local density approximation" @default.
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- W2017328435 doi "https://doi.org/10.1103/physreva.69.034701" @default.
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