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Theoretical study of the toroidal forms of carbon and related endohedral complexes with lithium

✍ Scribed by A. A. Kuzubov; P. V. Avramov; S. G. Ovchinnikov; S. A. Varganov; F. N. Tomilin

Book ID
110128292
Publisher
SP MAIK Nauka/Interperiodica
Year
2001
Tongue
English
Weight
152 KB
Volume
43
Category
Article
ISSN
1063-7834

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## Abstract __The lithium‐ and hydrogen‐bonded complex of HLiο£ΏNCHο£ΏNCH is studied with ab initio calculations. The optimized structure, vibrational frequencies, and binding energy are calculated at the MP2 level with 6‐311++G(2d,2p) basis set. The interplay between lithium bonding and hydrogen bondi