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Ab initio path to heavy nuclei

✍ Scribed by Binder, Sven; Langhammer, Joachim; Calci, Angelo; Roth, Robert


Book ID
125822675
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
402 KB
Volume
736
Category
Article
ISSN
0370-2693

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Ab initio path integral simulation of Ag
✍ Akihito Koizumi; Kimichi Suzuki; Motoyuki Shiga; Masanori Tachikawa πŸ“‚ Article πŸ“… 2011 πŸ› John Wiley and Sons 🌐 English βš– 331 KB

## Abstract Ab initio path integral molecular dynamics simulation of MOH(H~2~O) (M = Cu, Ag, and Au) clusters has been performed to analyze how the hydrogen‐bonded proton can be affected by the counter noble metal cation. The CuOH(H~2~O) cluster does not form hydrogen bonded structure even for the