@article{9fd6230b553e4d5a8233682821ee322c,
title = "MPWB1K calculations of stepwise encapsulations: Lix@C60",
abstract = "Computations are carried out on Li@C60, Li2@C60 and Li3@C60 with the newly introduced MPWB1K density functional. The computed equilibrium thermodynamics shows that Li2@C60 is at least by two orders of magnitude less populated than Li@C60 when the saturated Li vapor is considered while for Li3@C60 it is at least four orders of magnitude compared to Li@C60. The evaluations correspond to the available experimental findings.",
author = "Zden{\v e}k Slanina and Filip Uhl{\'i}k and Lee, {Shyi Long} and Ludwik Adamowicz and Shigeru Nagase",
note = "Funding Information: The reported research has been supported by a Grant-in-aid for NAREGI Nanoscience Project, for Scientific Research on Priority Area (A), and for the Next Generation Super Computing Project, Nanoscience Program, MEXT, Japan, by the National Science Council, Taiwan-ROC, and by the Czech National Research Program {\textquoteright}Information Society{\textquoteright} (Czech Acad. Sci. 1ET401110505). Last but not least, the constructive suggestions from the referees are highly appreciated, too.",
year = "2008",
month = sep,
day = "22",
doi = "10.1016/j.cplett.2008.07.105",
language = "English (US)",
volume = "463",
pages = "121--123",
journal = "Chemical Physics Letters",
issn = "0009-2614",
publisher = "Elsevier",
number = "1-3",
}